2-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-N-[4-chloranyl-2-(phenylcarbonyl)phenyl]ethanamide

Systemtic Name: 2-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-N-[4-chloranyl-2-(phenylcarbonyl)phenyl]ethanamide Openeye Name: 2-[4-(azepane-1-carbonyl)-1-piperidyl]-N-(2-benzoyl-4-chloro-phenyl)acetamide CAS Name: 2-[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-N-(2-benzoyl-4-chlorophenyl)acetamide IUPAC Name: 2-[4-(azepane-1-carbonyl)piperidin-1-yl]-N-(2-benzoyl-4-chlorophenyl)acetamide Traditional Name: 2-[4-(azepane-1-carbonyl)piperidino]-N-(2-benzoyl-4-chloro-phenyl)acetamide Formula: C27H32ClN3O3 MolecularWeight: 482.01428

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)CC(=O)NC3=C(C=C(C=C3)Cl)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)CC(=O)NC3=C(C=C(C=C3)Cl)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H32ClN3O3/c28-22-10-11-24(23(18-22)26(33)20-8-4-3-5-9-20)29-25(32)19-30-16-12-21(13-17-30)27(34)31-14-6-1-2-7-15-31/h3-5,8-11,18,21H,1-2,6-7,12-17,19H2,(H,29,32)