4-(azepan-1-ylmethyl)-N-[4-chloranyl-2-(phenylcarbonyl)phenyl]benzamide

Systemtic Name: 4-(azepan-1-ylmethyl)-N-[4-chloranyl-2-(phenylcarbonyl)phenyl]benzamide Openeye Name: 4-(azepan-1-ylmethyl)-N-(2-benzoyl-4-chloro-phenyl)benzamide CAS Name: 4-(1-azepanylmethyl)-N-(2-benzoyl-4-chlorophenyl)benzamide IUPAC Name: 4-(azepan-1-ylmethyl)-N-(2-benzoyl-4-chlorophenyl)benzamide Traditional Name: 4-(azepan-1-ylmethyl)-N-(2-benzoyl-4-chloro-phenyl)benzamide Formula: C27H27ClN2O2 MolecularWeight: 446.96848

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2=CC=C(C=C2)C(=O)NC3=C(C=C(C=C3)Cl)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)CC2=CC=C(C=C2)C(=O)NC3=C(C=C(C=C3)Cl)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H27ClN2O2/c28-23-14-15-25(24(18-23)26(31)21-8-4-3-5-9-21)29-27(32)22-12-10-20(11-13-22)19-30-16-6-1-2-7-17-30/h3-5,8-15,18H,1-2,6-7,16-17,19H2,(H,29,32)