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

Systemtic Name: N-[2-methyl-4-(2-methylpropyl)-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-2-phenyl-ethanamide Openeye Name: N-(4-isobutyl-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-2-phenyl-acetamide CAS Name: N-[2-methyl-4-(2-methylpropyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]-2-phenylacetamide IUPAC Name: N-[2-methyl-4-(2-methylpropyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]-2-phenylacetamide Traditional Name: N-(4-isobutyl-3-keto-2-methyl-5H-1,4-benzoxazepin-7-yl)-2-phenyl-acetamide Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)CC3=CC=CC=C3)CC(C)C

Isomeric SMILES

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)CC3=CC=CC=C3)CC(C)C

InChI

InChI=1S/C22H26N2O3/c1-15(2)13-24-14-18-12-19(9-10-20(18)27-16(3)22(24)26)23-21(25)11-17-7-5-4-6-8-17/h4-10,12,15-16H,11,13-14H2,1-3H3,(H,23,25)