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

Systemtic Name: (4-nitrophenyl) 5-ethanoyl-6-methyl-2-oxidanylidene-4-phenyl-1,4-dihydropyrimidine-3-carboxylate Openeye Name: (4-nitrophenyl) 5-acetyl-6-methyl-2-oxo-4-phenyl-1,4-dihydropyrimidine-3-carboxylate CAS Name: 5-acetyl-6-methyl-2-oxo-4-phenyl-1,4-dihydropyrimidine-3-carboxylic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 5-acetyl-6-methyl-2-oxo-4-phenyl-1,4-dihydropyrimidine-3-carboxylate Traditional Name: 5-acetyl-2-keto-6-methyl-4-phenyl-1,4-dihydropyrimidine-3-carboxylic acid (4-nitrophenyl) ester Formula: C20H17N3O6 MolecularWeight: 395.36548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N(C(=O)N1)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3)C(=O)C

Isomeric SMILES

CC1=C(C(N(C(=O)N1)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3)C(=O)C

InChI

InChI=1S/C20H17N3O6/c1-12-17(13(2)24)18(14-6-4-3-5-7-14)22(19(25)21-12)20(26)29-16-10-8-15(9-11-16)23(27)28/h3-11,18H,1-2H3,(H,21,25)