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

Systemtic Name: (phenylmethyl) N-[2-methyl-4-(3-methylbutyl)-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]carbamate Openeye Name: benzyl N-(4-isopentyl-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl)carbamate CAS Name: N-[2-methyl-4-(3-methylbutyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[2-methyl-4-(3-methylbutyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]carbamate Traditional Name: N-(4-isoamyl-3-keto-2-methyl-5H-1,4-benzoxazepin-7-yl)carbamic acid benzyl ester Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)OCC3=CC=CC=C3)CCC(C)C

Isomeric SMILES

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)OCC3=CC=CC=C3)CCC(C)C

InChI

InChI=1S/C23H28N2O4/c1-16(2)11-12-25-14-19-13-20(9-10-21(19)29-17(3)22(25)26)24-23(27)28-15-18-7-5-4-6-8-18/h4-10,13,16-17H,11-12,14-15H2,1-3H3,(H,24,27)