(4-nitrophenyl) N-(1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)carbamate

Systemtic Name: (4-nitrophenyl) N-(1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)carbamate Openeye Name: (4-nitrophenyl) N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)carbamate CAS Name: N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)carbamic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)carbamate Traditional Name: N-(2-keto-1-methyl-5-phenyl-3H-1,4-benzodiazepin-3-yl)carbamic acid (4-nitrophenyl) ester Formula: C23H18N4O5 MolecularWeight: 430.41282

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)OC3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)OC3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C23H18N4O5/c1-26-19-10-6-5-9-18(19)20(15-7-3-2-4-8-15)24-21(22(26)28)25-23(29)32-17-13-11-16(12-14-17)27(30)31/h2-14,21H,1H3,(H,25,29)