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

Systemtic Name: (phenylmethyl) N-(8-bromanyl-5-methyl-2-oxidanylidene-3,4-dihydro-1,4-benzodiazepin-3-yl)carbamate Openeye Name: benzyl N-(8-bromo-5-methyl-2-oxo-3,4-dihydro-1,4-benzodiazepin-3-yl)carbamate CAS Name: N-(8-bromo-5-methyl-2-oxo-3,4-dihydro-1,4-benzodiazepin-3-yl)carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(8-bromo-5-methyl-2-oxo-3,4-dihydro-1,4-benzodiazepin-3-yl)carbamate Traditional Name: N-(8-bromo-2-keto-5-methyl-3,4-dihydro-1,4-benzodiazepin-3-yl)carbamic acid benzyl ester Formula: C18H16BrN3O3 MolecularWeight: 402.24194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC(=CC2=NC(=O)C(N1)NC(=O)OCC3=CC=CC=C3)Br

Isomeric SMILES

CC1=C2C=CC(=CC2=NC(=O)C(N1)NC(=O)OCC3=CC=CC=C3)Br

InChI

InChI=1S/C18H16BrN3O3/c1-11-14-8-7-13(19)9-15(14)21-17(23)16(20-11)22-18(24)25-10-12-5-3-2-4-6-12/h2-9,16,20H,10H2,1H3,(H,22,24)