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

Systemtic Name: (phenylmethyl) N-(4-cyclopropyl-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl)carbamate Openeye Name: benzyl N-(4-cyclopropyl-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl)carbamate CAS Name: N-(4-cyclopropyl-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl)carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(4-cyclopropyl-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl)carbamate Traditional Name: N-(4-cyclopropyl-3-keto-2-methyl-5H-1,4-benzoxazepin-7-yl)carbamic acid benzyl ester Formula: C21H22N2O4 MolecularWeight: 366.41038

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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)C4CC4

Isomeric SMILES

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)OCC3=CC=CC=C3)C4CC4

InChI

InChI=1S/C21H22N2O4/c1-14-20(24)23(18-8-9-18)12-16-11-17(7-10-19(16)27-14)22-21(25)26-13-15-5-3-2-4-6-15/h2-7,10-11,14,18H,8-9,12-13H2,1H3,(H,22,25)