(phenylmethyl) N-(8-bromanyl-1,5-dimethyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl)carbamate

Systemtic Name: (phenylmethyl) N-(8-bromanyl-1,5-dimethyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl)carbamate Openeye Name: benzyl N-(8-bromo-1,5-dimethyl-2-oxo-3H-1,4-benzodiazepin-3-yl)carbamate CAS Name: N-(8-bromo-1,5-dimethyl-2-oxo-3H-1,4-benzodiazepin-3-yl)carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(8-bromo-1,5-dimethyl-2-oxo-3H-1,4-benzodiazepin-3-yl)carbamate Traditional Name: N-(8-bromo-2-keto-1,5-dimethyl-3H-1,4-benzodiazepin-3-yl)carbamic acid benzyl ester Formula: C19H18BrN3O3 MolecularWeight: 416.26852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(C(=O)N(C2=C1C=CC(=C2)Br)C)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=NC(C(=O)N(C2=C1C=CC(=C2)Br)C)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C19H18BrN3O3/c1-12-15-9-8-14(20)10-16(15)23(2)18(24)17(21-12)22-19(25)26-11-13-6-4-3-5-7-13/h3-10,17H,11H2,1-2H3,(H,22,25)