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

Systemtic Name: 2-methylpropyl 3-ethanoyl-6-methyl-4-(3-nitrophenyl)-2-oxidanylidene-1,4-dihydropyrimidine-5-carboxylate Openeye Name: isobutyl 3-acetyl-6-methyl-4-(3-nitrophenyl)-2-oxo-1,4-dihydropyrimidine-5-carboxylate CAS Name: 3-acetyl-6-methyl-4-(3-nitrophenyl)-2-oxo-1,4-dihydropyrimidine-5-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3-acetyl-6-methyl-4-(3-nitrophenyl)-2-oxo-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 3-acetyl-2-keto-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyrimidine-5-carboxylic acid isobutyl ester Formula: C18H21N3O6 MolecularWeight: 375.37584

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O6/c1-10(2)9-27-17(23)15-11(3)19-18(24)20(12(4)22)16(15)13-6-5-7-14(8-13)21(25)26/h5-8,10,16H,9H2,1-4H3,(H,19,24)