2-[3-(hydroxymethyl)-5-methyl-1,2,4-triazol-4-yl]benzoic acid

Systemtic Name: 2-[3-(hydroxymethyl)-5-methyl-1,2,4-triazol-4-yl]benzoic acid Openeye Name: 2-[3-(hydroxymethyl)-5-methyl-1,2,4-triazol-4-yl]benzoic acid CAS Name: 2-[3-(hydroxymethyl)-5-methyl-1,2,4-triazol-4-yl]benzoic acid IUPAC Name: 2-[3-(hydroxymethyl)-5-methyl-1,2,4-triazol-4-yl]benzoic acid Traditional Name: 2-(3-methyl-5-methylol-1,2,4-triazol-4-yl)benzoic acid Formula: C11H11N3O3 MolecularWeight: 233.22334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2=CC=CC=C2C(=O)O)CO

Isomeric SMILES

CC1=NN=C(N1C2=CC=CC=C2C(=O)O)CO

InChI

InChI=1S/C11H11N3O3/c1-7-12-13-10(6-15)14(7)9-5-3-2-4-8(9)11(16)17/h2-5,15H,6H2,1H3,(H,16,17)