2-(3,4-dimethylphenyl)pyrimidine-5-carboxylic acid

Systemtic Name: 2-(3,4-dimethylphenyl)pyrimidine-5-carboxylic acid Openeye Name: 2-(3,4-dimethylphenyl)pyrimidine-5-carboxylic acid CAS Name: 2-(3,4-dimethylphenyl)-5-pyrimidinecarboxylic acid IUPAC Name: 2-(3,4-dimethylphenyl)pyrimidine-5-carboxylic acid Traditional Name: 2-(3,4-dimethylphenyl)pyrimidine-5-carboxylic acid Formula: C13H12N2O2 MolecularWeight: 228.24658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC=C(C=N2)C(=O)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC=C(C=N2)C(=O)O)C

InChI

InChI=1S/C13H12N2O2/c1-8-3-4-10(5-9(8)2)12-14-6-11(7-15-12)13(16)17/h3-7H,1-2H3,(H,16,17)