(phenylmethyl) N-[1-(1-chloranyl-1-oxidanylidene-propan-2-yl)-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-(1-chloranyl-1-oxidanylidene-propan-2-yl)-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl]carbamate Openeye Name: benzyl N-[1-(2-chloro-1-methyl-2-oxo-ethyl)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]carbamate CAS Name: N-[1-(1-chloro-1-oxopropan-2-yl)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-(1-chloro-1-oxopropan-2-yl)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]carbamate Traditional Name: N-[1-(2-chloro-2-keto-1-methyl-ethyl)-2-keto-5-phenyl-3H-1,4-benzodiazepin-3-yl]carbamic acid benzyl ester Formula: C26H22ClN3O4 MolecularWeight: 475.92358

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)Cl)N1C2=CC=CC=C2C(=NC(C1=O)NC(=O)OCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)Cl)N1C2=CC=CC=C2C(=NC(C1=O)NC(=O)OCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H22ClN3O4/c1-17(23(27)31)30-21-15-9-8-14-20(21)22(19-12-6-3-7-13-19)28-24(25(30)32)29-26(33)34-16-18-10-4-2-5-11-18/h2-15,17,24H,16H2,1H3,(H,29,33)