N-[2-(azepan-1-yl)ethyl]-1-(4-chlorophenyl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(azepan-1-yl)ethyl]-1-(4-chlorophenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-[2-(azepan-1-yl)ethyl]-1-(4-chlorobenzoyl)piperidine-4-carboxamide CAS Name: N-[2-(1-azepanyl)ethyl]-1-[(4-chlorophenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-[2-(azepan-1-yl)ethyl]-1-(4-chlorobenzoyl)piperidine-4-carboxamide Traditional Name: N-[2-(azepan-1-yl)ethyl]-1-(4-chlorobenzoyl)isonipecotamide Formula: C21H30ClN3O2 MolecularWeight: 391.9348

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCNC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCCN(CC1)CCNC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H30ClN3O2/c22-19-7-5-18(6-8-19)21(27)25-14-9-17(10-15-25)20(26)23-11-16-24-12-3-1-2-4-13-24/h5-8,17H,1-4,9-16H2,(H,23,26)