2-(2,6-dimethyl-4-oxidanylidene-1H-pyrimidin-5-yl)benzoic acid

Systemtic Name: 2-(2,6-dimethyl-4-oxidanylidene-1H-pyrimidin-5-yl)benzoic acid Openeye Name: 2-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)benzoic acid CAS Name: 2-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)benzoic acid IUPAC Name: 2-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)benzoic acid Traditional Name: 2-(4-keto-2,6-dimethyl-1H-pyrimidin-5-yl)benzoic acid Formula: C13H12N2O3 MolecularWeight: 244.24598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)C)C2=CC=CC=C2C(=O)O

Isomeric SMILES

CC1=C(C(=O)N=C(N1)C)C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C13H12N2O3/c1-7-11(12(16)15-8(2)14-7)9-5-3-4-6-10(9)13(17)18/h3-6H,1-2H3,(H,17,18)(H,14,15,16)