3-(2-chloranyl-6-methyl-pyrimidin-4-yl)benzoic acid

Systemtic Name: 3-(2-chloranyl-6-methyl-pyrimidin-4-yl)benzoic acid Openeye Name: 3-(2-chloro-6-methyl-pyrimidin-4-yl)benzoic acid CAS Name: 3-(2-chloro-6-methyl-4-pyrimidinyl)benzoic acid IUPAC Name: 3-(2-chloro-6-methylpyrimidin-4-yl)benzoic acid Traditional Name: 3-(2-chloro-6-methyl-pyrimidin-4-yl)benzoic acid Formula: C12H9ClN2O2 MolecularWeight: 248.66506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC(=CC=C2)C(=O)O)Cl

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC(=CC=C2)C(=O)O)Cl

InChI

InChI=1S/C12H9ClN2O2/c1-7-5-10(15-12(13)14-7)8-3-2-4-9(6-8)11(16)17/h2-6H,1H3,(H,16,17)