1-(3,4-dichlorophenyl)carbonyl-N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]piperidine-3-carboxamide

Systemtic Name: 1-(3,4-dichlorophenyl)carbonyl-N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]piperidine-3-carboxamide Openeye Name: 1-(3,4-dichlorobenzoyl)-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]piperidine-3-carboxamide CAS Name: 1-[(3,4-dichlorophenyl)-oxomethyl]-N-[[4-(3-oxo-1-piperazinyl)phenyl]methyl]-3-piperidinecarboxamide IUPAC Name: 1-(3,4-dichlorobenzoyl)-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]piperidine-3-carboxamide Traditional Name: 1-(3,4-dichlorobenzoyl)-N-[4-(3-ketopiperazino)benzyl]nipecotamide Formula: C24H26Cl2N4O3 MolecularWeight: 489.39424

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC(=C(C=C2)Cl)Cl)C(=O)NCC3=CC=C(C=C3)N4CCNC(=O)C4

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC(=C(C=C2)Cl)Cl)C(=O)NCC3=CC=C(C=C3)N4CCNC(=O)C4

InChI

InChI=1S/C24H26Cl2N4O3/c25-20-8-5-17(12-21(20)26)24(33)30-10-1-2-18(14-30)23(32)28-13-16-3-6-19(7-4-16)29-11-9-27-22(31)15-29/h3-8,12,18H,1-2,9-11,13-15H2,(H,27,31)(H,28,32)