2-[(4-methylphenyl)methyl]-6-oxidanylidene-1H-pyrimidine-5-carboxylic acid

Systemtic Name: 2-[(4-methylphenyl)methyl]-6-oxidanylidene-1H-pyrimidine-5-carboxylic acid Openeye Name: 6-oxo-2-(p-tolylmethyl)-1H-pyrimidine-5-carboxylic acid CAS Name: 2-[(4-methylphenyl)methyl]-6-oxo-1H-pyrimidine-5-carboxylic acid IUPAC Name: 2-[(4-methylphenyl)methyl]-6-oxo-1H-pyrimidine-5-carboxylic acid Traditional Name: 6-keto-2-(4-methylbenzyl)-1H-pyrimidine-5-carboxylic acid Formula: C13H12N2O3 MolecularWeight: 244.24598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=NC=C(C(=O)N2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)CC2=NC=C(C(=O)N2)C(=O)O

InChI

InChI=1S/C13H12N2O3/c1-8-2-4-9(5-3-8)6-11-14-7-10(13(17)18)12(16)15-11/h2-5,7H,6H2,1H3,(H,17,18)(H,14,15,16)