3-[5-(hydroxymethyl)-2-methyl-pyrazol-3-yl]benzoic acid

Systemtic Name: 3-[5-(hydroxymethyl)-2-methyl-pyrazol-3-yl]benzoic acid Openeye Name: 3-[5-(hydroxymethyl)-2-methyl-pyrazol-3-yl]benzoic acid CAS Name: 3-[5-(hydroxymethyl)-2-methyl-3-pyrazolyl]benzoic acid IUPAC Name: 3-[5-(hydroxymethyl)-2-methylpyrazol-3-yl]benzoic acid Traditional Name: 3-(2-methyl-5-methylol-pyrazol-3-yl)benzoic acid Formula: C12H12N2O3 MolecularWeight: 232.23528

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=N1)CO)C2=CC(=CC=C2)C(=O)O

Isomeric SMILES

CN1C(=CC(=N1)CO)C2=CC(=CC=C2)C(=O)O

InChI

InChI=1S/C12H12N2O3/c1-14-11(6-10(7-15)13-14)8-3-2-4-9(5-8)12(16)17/h2-6,15H,7H2,1H3,(H,16,17)