methyl 6-(3-cyanophenyl)-4-methyl-3-(3-nitrophenyl)-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl 6-(3-cyanophenyl)-4-methyl-3-(3-nitrophenyl)-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl 6-(3-cyanophenyl)-4-methyl-3-(3-nitrophenyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(3-cyanophenyl)-4-methyl-3-(3-nitrophenyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 6-(3-cyanophenyl)-4-methyl-3-(3-nitrophenyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(3-cyanophenyl)-2-keto-4-methyl-3-(3-nitrophenyl)-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C20H16N4O5 MolecularWeight: 392.36484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC(=C3)C#N)C(=O)OC

Isomeric SMILES

CC1=C(C(NC(=O)N1C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC(=C3)C#N)C(=O)OC

InChI

InChI=1S/C20H16N4O5/c1-12-17(19(25)29-2)18(14-6-3-5-13(9-14)11-21)22-20(26)23(12)15-7-4-8-16(10-15)24(27)28/h3-10,18H,1-2H3,(H,22,26)