N-methyl-2-(7-nitro-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl)ethanamide

Systemtic Name: N-methyl-2-(7-nitro-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl)ethanamide Openeye Name: N-methyl-2-(7-nitro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)acetamide CAS Name: N-methyl-2-(7-nitro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)acetamide IUPAC Name: N-methyl-2-(7-nitro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)acetamide Traditional Name: 2-(2-keto-7-nitro-5-phenyl-3H-1,4-benzodiazepin-1-yl)-N-methyl-acetamide Formula: C18H16N4O4 MolecularWeight: 352.34404

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CN1C(=O)CN=C(C2=C1C=CC(=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CNC(=O)CN1C(=O)CN=C(C2=C1C=CC(=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C18H16N4O4/c1-19-16(23)11-21-15-8-7-13(22(25)26)9-14(15)18(20-10-17(21)24)12-5-3-2-4-6-12/h2-9H,10-11H2,1H3,(H,19,23)