N-[4-[(4-chlorophenyl)methyl]-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-2-phenyl-ethanamide

Systemtic Name: N-[4-[(4-chlorophenyl)methyl]-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-2-phenyl-ethanamide Openeye Name: N-[4-[(4-chlorophenyl)methyl]-3-oxo-5H-1,4-benzoxazepin-7-yl]-2-phenyl-acetamide CAS Name: N-[4-[(4-chlorophenyl)methyl]-3-oxo-5H-1,4-benzoxazepin-7-yl]-2-phenylacetamide IUPAC Name: N-[4-[(4-chlorophenyl)methyl]-3-oxo-5H-1,4-benzoxazepin-7-yl]-2-phenylacetamide Traditional Name: N-[4-(4-chlorobenzyl)-3-keto-5H-1,4-benzoxazepin-7-yl]-2-phenyl-acetamide Formula: C24H21ClN2O3 MolecularWeight: 420.88814

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)NC(=O)CC3=CC=CC=C3)OCC(=O)N1CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1C2=C(C=CC(=C2)NC(=O)CC3=CC=CC=C3)OCC(=O)N1CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H21ClN2O3/c25-20-8-6-18(7-9-20)14-27-15-19-13-21(10-11-22(19)30-16-24(27)29)26-23(28)12-17-4-2-1-3-5-17/h1-11,13H,12,14-16H2,(H,26,28)