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

Systemtic Name: (phenylmethyl) N-[4-(2-methylpropyl)-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]carbamate Openeye Name: benzyl N-(4-isobutyl-3-oxo-5H-1,4-benzoxazepin-7-yl)carbamate CAS Name: N-[4-(2-methylpropyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[4-(2-methylpropyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]carbamate Traditional Name: N-(4-isobutyl-3-keto-5H-1,4-benzoxazepin-7-yl)carbamic acid benzyl ester Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CC2=C(C=CC(=C2)NC(=O)OCC3=CC=CC=C3)OCC1=O

Isomeric SMILES

CC(C)CN1CC2=C(C=CC(=C2)NC(=O)OCC3=CC=CC=C3)OCC1=O

InChI

InChI=1S/C21H24N2O4/c1-15(2)11-23-12-17-10-18(8-9-19(17)26-14-20(23)24)22-21(25)27-13-16-6-4-3-5-7-16/h3-10,15H,11-14H2,1-2H3,(H,22,25)