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

Systemtic Name: propan-2-yl 4-methyl-6-(3-nitrophenyl)-2-oxidanylidene-3-phenyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: isopropyl 4-methyl-6-(3-nitrophenyl)-2-oxo-3-phenyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 4-methyl-6-(3-nitrophenyl)-2-oxo-3-phenyl-1,6-dihydropyrimidine-5-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-methyl-6-(3-nitrophenyl)-2-oxo-3-phenyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 2-keto-4-methyl-6-(3-nitrophenyl)-3-phenyl-1,6-dihydropyrimidine-5-carboxylic acid isopropyl ester Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O5/c1-13(2)29-20(25)18-14(3)23(16-9-5-4-6-10-16)21(26)22-19(18)15-8-7-11-17(12-15)24(27)28/h4-13,19H,1-3H3,(H,22,26)