methyl 4-[2-(6-nitro-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-(6-nitro-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]benzoate Openeye Name: methyl 4-[[2-(6-nitro-4-oxo-quinazolin-3-yl)acetyl]amino]benzoate CAS Name: 4-[[2-(6-nitro-4-oxo-3-quinazolinyl)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(6-nitro-4-oxoquinazolin-3-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(4-keto-6-nitro-quinazolin-3-yl)acetyl]amino]benzoic acid methyl ester Formula: C18H14N4O6 MolecularWeight: 382.32696

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H14N4O6/c1-28-18(25)11-2-4-12(5-3-11)20-16(23)9-21-10-19-15-7-6-13(22(26)27)8-14(15)17(21)24/h2-8,10H,9H2,1H3,(H,20,23)