methyl 2-(2-methoxy-2-oxidanylidene-ethyl)-3-[(4-nitrophenyl)carbonylamino]-4-oxidanylidene-1H-quinazoline-2-carboxylate

Systemtic Name: methyl 2-(2-methoxy-2-oxidanylidene-ethyl)-3-[(4-nitrophenyl)carbonylamino]-4-oxidanylidene-1H-quinazoline-2-carboxylate Openeye Name: methyl 2-(2-methoxy-2-oxo-ethyl)-3-[(4-nitrobenzoyl)amino]-4-oxo-1H-quinazoline-2-carboxylate CAS Name: 2-(2-methoxy-2-oxoethyl)-3-[[(4-nitrophenyl)-oxomethyl]amino]-4-oxo-1H-quinazoline-2-carboxylic acid methyl ester IUPAC Name: methyl 2-(2-methoxy-2-oxoethyl)-3-[(4-nitrobenzoyl)amino]-4-oxo-1H-quinazoline-2-carboxylate Traditional Name: 4-keto-2-(2-keto-2-methoxy-ethyl)-3-[(4-nitrobenzoyl)amino]-1H-quinazoline-2-carboxylic acid methyl ester Formula: C20H18N4O8 MolecularWeight: 442.37892

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1(NC2=CC=CC=C2C(=O)N1NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

COC(=O)CC1(NC2=CC=CC=C2C(=O)N1NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C20H18N4O8/c1-31-16(25)11-20(19(28)32-2)21-15-6-4-3-5-14(15)18(27)23(20)22-17(26)12-7-9-13(10-8-12)24(29)30/h3-10,21H,11H2,1-2H3,(H,22,26)