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Depiction
Precursor
1-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butyl]-4-(2-methoxyphenyl)piperazin-1-ium
COC1=CC=CC=C1N2CCN(CC2)CCCC[NH+]3C(=O)C4=CC=CC=C4C3=O
7 steps
Depiction
Dead-End Product
Succinyl-carboxylic acid
C(CCC(=O)C(=O)O)(=O)C(O)=O
Depiction
Precursor
1-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butyl]-4-(2-methoxyphenyl)piperazin-1-ium
COC1=CC=CC=C1N2CCN(CC2)CCCC[NH+]3C(=O)C4=CC=CC=C4C3=O
10 steps
Depiction
Dead-End Product
1,2,4-Butantriol Alkohol
C(CC(C(O)O)O)O
Depiction
Precursor
1-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butyl]-4-(2-methoxyphenyl)piperazin-1-ium
COC1=CC=CC=C1N2CCN(CC2)CCCC[NH+]3C(=O)C4=CC=CC=C4C3=O
7 steps
Depiction
Dead-End Product
CID 22568690
C([N+](=O)[O-])([O-])=O
Depiction
Upstream Precursor
COC1=CC=CC=C1N2CCN(CC2)CCCC[N+]3(C(=O)C4=CC=CC=C4C3=O)[O-]
Depth 1
Depiction
Product
1-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butyl]-4-(2-methoxyphenyl)piperazin-1-ium
COC1=CC=CC=C1N2CCN(CC2)CCCC[NH+]3C(=O)C4=CC=CC=C4C3=O
Depiction
Upstream Precursor
COC1=CC=CC=C1[N+]2(CCN(CC2)CCCCN3C(=O)C4=CC=CC=C4C3=O)[O-]
Depth 1
Depiction
Product
1-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butyl]-4-(2-methoxyphenyl)piperazin-1-ium
COC1=CC=CC=C1N2CCN(CC2)CCCC[NH+]3C(=O)C4=CC=CC=C4C3=O
Depiction
Upstream Precursor
COC1=CC=CC=C1N2CC[N+](CC2)(CCCCN3C(=O)C4=CC=CC=C4C3=O)[O-]
Depth 1
Depiction
Product
1-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butyl]-4-(2-methoxyphenyl)piperazin-1-ium
COC1=CC=CC=C1N2CCN(CC2)CCCC[NH+]3C(=O)C4=CC=CC=C4C3=O
Depiction
Upstream Precursor
COC1=CC=CC=C1[N+]2(CCN(CC2)CCCC[N+]3(C(=O)C4=CC=CC=C4C3=O)[O-])[O-]
Depth 2
Depiction
Product
1-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butyl]-4-(2-methoxyphenyl)piperazin-1-ium
COC1=CC=CC=C1N2CCN(CC2)CCCC[NH+]3C(=O)C4=CC=CC=C4C3=O
Depiction
Upstream Precursor
COC1=CC=CC=C1N2CC[N+](CC2)(CCCC[N+]3(C(=O)C4=CC=CC=C4C3=O)[O-])[O-]
Depth 2
Depiction
Product
1-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butyl]-4-(2-methoxyphenyl)piperazin-1-ium
COC1=CC=CC=C1N2CCN(CC2)CCCC[NH+]3C(=O)C4=CC=CC=C4C3=O
Depiction
Upstream Precursor
COC1=CC=CC=C1[N+]2(CC[N+](CC2)(CCCCN3C(=O)C4=CC=CC=C4C3=O)[O-])[O-]
Depth 2
Depiction
Product
1-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butyl]-4-(2-methoxyphenyl)piperazin-1-ium
COC1=CC=CC=C1N2CCN(CC2)CCCC[NH+]3C(=O)C4=CC=CC=C4C3=O
Depiction
Precursor
1-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butyl]-4-(2-methoxyphenyl)piperazin-1-ium
COC1=CC=CC=C1N2CCN(CC2)CCCC[NH+]3C(=O)C4=CC=CC=C4C3=O
Depth 3
Depiction
Downstream Successor
Benzoic Acid
C1=CC(=CC=C1)C(O)=O
Depiction
Precursor
1-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butyl]-4-(2-methoxyphenyl)piperazin-1-ium
COC1=CC=CC=C1N2CCN(CC2)CCCC[NH+]3C(=O)C4=CC=CC=C4C3=O
Depth 3
Depiction
Downstream Successor
2-Hydroxyhexa-2,4-diendioic acid
C(=CC=CC(=O)O)(C(O)=O)O
Depiction
Precursor
1-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butyl]-4-(2-methoxyphenyl)piperazin-1-ium
COC1=CC=CC=C1N2CCN(CC2)CCCC[NH+]3C(=O)C4=CC=CC=C4C3=O
Depth 2
Depiction
Downstream Successor
2,4-Hexadienedioic acid, (2Z,4Z)-
C(C=CC=CC(=O)O)(O)=O
Depiction
Precursor
1-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butyl]-4-(2-methoxyphenyl)piperazin-1-ium
COC1=CC=CC=C1N2CCN(CC2)CCCC[NH+]3C(=O)C4=CC=CC=C4C3=O
Depth 3
Depiction
Downstream Successor
3-Hydroxyhexa-2,4-dienedioic acid
C(C=CC(=O)O)(=CC(O)=O)O
Depiction
Precursor
1-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butyl]-4-(2-methoxyphenyl)piperazin-1-ium
COC1=CC=CC=C1N2CCN(CC2)CCCC[NH+]3C(=O)C4=CC=CC=C4C3=O
Depth 3
Depiction
Downstream Successor
2-Methoxyaniline
C1=CC(=C(C=C1)OC)N
Depiction
Precursor
1-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butyl]-4-(2-methoxyphenyl)piperazin-1-ium
COC1=CC=CC=C1N2CCN(CC2)CCCC[NH+]3C(=O)C4=CC=CC=C4C3=O
Depth 3
Depiction
Downstream Successor
CID 417
C(C=C(C=CC(O)=O)Cl)(O)=O
No Original Precursors

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