4-(3-chlorophenyl)-N-[3-(2-oxidanylideneazepan-1-yl)propyl]piperazine-1-carboxamide

Systemtic Name: 4-(3-chlorophenyl)-N-[3-(2-oxidanylideneazepan-1-yl)propyl]piperazine-1-carboxamide Openeye Name: 4-(3-chlorophenyl)-N-[3-(2-oxoazepan-1-yl)propyl]piperazine-1-carboxamide CAS Name: 4-(3-chlorophenyl)-N-[3-(2-oxo-1-azepanyl)propyl]-1-piperazinecarboxamide IUPAC Name: 4-(3-chlorophenyl)-N-[3-(2-oxoazepan-1-yl)propyl]piperazine-1-carboxamide Traditional Name: 4-(3-chlorophenyl)-N-[3-(2-ketoazepan-1-yl)propyl]piperazine-1-carboxamide Formula: C20H29ClN4O2 MolecularWeight: 392.92286

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CCCNC(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl

Isomeric SMILES

C1CCC(=O)N(CC1)CCCNC(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H29ClN4O2/c21-17-6-4-7-18(16-17)23-12-14-25(15-13-23)20(27)22-9-5-11-24-10-3-1-2-8-19(24)26/h4,6-7,16H,1-3,5,8-15H2,(H,22,27)