3-[3-[2-(azepan-1-yl)ethylcarbamoyl]phenyl]-N-(4-chlorophenyl)piperidine-1-carboxamide

Systemtic Name: 3-[3-[2-(azepan-1-yl)ethylcarbamoyl]phenyl]-N-(4-chlorophenyl)piperidine-1-carboxamide Openeye Name: 3-[3-[2-(azepan-1-yl)ethylcarbamoyl]phenyl]-N-(4-chlorophenyl)piperidine-1-carboxamide CAS Name: 3-[3-[[2-(1-azepanyl)ethylamino]-oxomethyl]phenyl]-N-(4-chlorophenyl)-1-piperidinecarboxamide IUPAC Name: 3-[3-[2-(azepan-1-yl)ethylcarbamoyl]phenyl]-N-(4-chlorophenyl)piperidine-1-carboxamide Traditional Name: 3-[3-[2-(azepan-1-yl)ethylcarbamoyl]phenyl]-N-(4-chlorophenyl)piperidine-1-carboxamide Formula: C27H35ClN4O2 MolecularWeight: 483.0454

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCNC(=O)C2=CC(=CC=C2)C3CCCN(C3)C(=O)NC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCCN(CC1)CCNC(=O)C2=CC(=CC=C2)C3CCCN(C3)C(=O)NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C27H35ClN4O2/c28-24-10-12-25(13-11-24)30-27(34)32-17-6-9-23(20-32)21-7-5-8-22(19-21)26(33)29-14-18-31-15-3-1-2-4-16-31/h5,7-8,10-13,19,23H,1-4,6,9,14-18,20H2,(H,29,33)(H,30,34)