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

Systemtic Name: 3-[3-[2-(azepan-1-yl)ethylcarbamoyl]phenyl]-N-phenyl-piperidine-1-carboxamide Openeye Name: 3-[3-[2-(azepan-1-yl)ethylcarbamoyl]phenyl]-N-phenyl-piperidine-1-carboxamide CAS Name: 3-[3-[[2-(1-azepanyl)ethylamino]-oxomethyl]phenyl]-N-phenyl-1-piperidinecarboxamide IUPAC Name: 3-[3-[2-(azepan-1-yl)ethylcarbamoyl]phenyl]-N-phenylpiperidine-1-carboxamide Traditional Name: 3-[3-[2-(azepan-1-yl)ethylcarbamoyl]phenyl]-N-phenyl-piperidine-1-carboxamide Formula: C27H36N4O2 MolecularWeight: 448.60034

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H36N4O2/c32-26(28-15-19-30-16-6-1-2-7-17-30)23-11-8-10-22(20-23)24-12-9-18-31(21-24)27(33)29-25-13-4-3-5-14-25/h3-5,8,10-11,13-14,20,24H,1-2,6-7,9,12,15-19,21H2,(H,28,32)(H,29,33)