6-methyl-4-(3-nitrophenyl)-2-oxidanylidene-3-(phenylmethyl)-1,4-dihydropyrimidine-5-carboxylic acid

Systemtic Name: 6-methyl-4-(3-nitrophenyl)-2-oxidanylidene-3-(phenylmethyl)-1,4-dihydropyrimidine-5-carboxylic acid Openeye Name: 3-benzyl-6-methyl-4-(3-nitrophenyl)-2-oxo-1,4-dihydropyrimidine-5-carboxylic acid CAS Name: 6-methyl-4-(3-nitrophenyl)-2-oxo-3-(phenylmethyl)-1,4-dihydropyrimidine-5-carboxylic acid IUPAC Name: 3-benzyl-6-methyl-4-(3-nitrophenyl)-2-oxo-1,4-dihydropyrimidine-5-carboxylic acid Traditional Name: 3-benzyl-2-keto-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyrimidine-5-carboxylic acid Formula: C19H17N3O5 MolecularWeight: 367.35538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N(C(=O)N1)CC2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1=C(C(N(C(=O)N1)CC2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C19H17N3O5/c1-12-16(18(23)24)17(14-8-5-9-15(10-14)22(26)27)21(19(25)20-12)11-13-6-3-2-4-7-13/h2-10,17H,11H2,1H3,(H,20,25)(H,23,24)