dimethyl 6-(4-nitrophenyl)-2-oxidanylidene-3-phenyl-1,6-dihydropyrimidine-4,5-dicarboxylate

Systemtic Name: dimethyl 6-(4-nitrophenyl)-2-oxidanylidene-3-phenyl-1,6-dihydropyrimidine-4,5-dicarboxylate Openeye Name: dimethyl 6-(4-nitrophenyl)-2-oxo-3-phenyl-1,6-dihydropyrimidine-4,5-dicarboxylate CAS Name: 6-(4-nitrophenyl)-2-oxo-3-phenyl-1,6-dihydropyrimidine-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 6-(4-nitrophenyl)-2-oxo-3-phenyl-1,6-dihydropyrimidine-4,5-dicarboxylate Traditional Name: 2-keto-6-(4-nitrophenyl)-3-phenyl-1,6-dihydropyrimidine-4,5-dicarboxylic acid dimethyl ester Formula: C20H17N3O7 MolecularWeight: 411.36488

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(C(=O)NC1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(N(C(=O)NC1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C20H17N3O7/c1-29-18(24)15-16(12-8-10-14(11-9-12)23(27)28)21-20(26)22(17(15)19(25)30-2)13-6-4-3-5-7-13/h3-11,16H,1-2H3,(H,21,26)