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

Systemtic Name: N-[2-methyl-3-oxidanylidene-4-(phenylmethyl)-5H-1,4-benzoxazepin-7-yl]-2-phenyl-butanamide Openeye Name: N-(4-benzyl-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-2-phenyl-butanamide CAS Name: N-[2-methyl-3-oxo-4-(phenylmethyl)-5H-1,4-benzoxazepin-7-yl]-2-phenylbutanamide IUPAC Name: N-(4-benzyl-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-2-phenylbutanamide Traditional Name: N-(4-benzyl-3-keto-2-methyl-5H-1,4-benzoxazepin-7-yl)-2-phenyl-butyramide Formula: C27H28N2O3 MolecularWeight: 428.52282

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NC2=CC3=C(C=C2)OC(C(=O)N(C3)CC4=CC=CC=C4)C

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)NC2=CC3=C(C=C2)OC(C(=O)N(C3)CC4=CC=CC=C4)C

InChI

InChI=1S/C27H28N2O3/c1-3-24(21-12-8-5-9-13-21)26(30)28-23-14-15-25-22(16-23)18-29(27(31)19(2)32-25)17-20-10-6-4-7-11-20/h4-16,19,24H,3,17-18H2,1-2H3,(H,28,30)