2-(3-ethyl-1,2,4-triazol-4-yl)benzoic acid

Systemtic Name: 2-(3-ethyl-1,2,4-triazol-4-yl)benzoic acid Openeye Name: 2-(3-ethyl-1,2,4-triazol-4-yl)benzoic acid CAS Name: 2-(3-ethyl-1,2,4-triazol-4-yl)benzoic acid IUPAC Name: 2-(3-ethyl-1,2,4-triazol-4-yl)benzoic acid Traditional Name: 2-(3-ethyl-1,2,4-triazol-4-yl)benzoic acid Formula: C11H11N3O2 MolecularWeight: 217.22394

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=CN1C2=CC=CC=C2C(=O)O

Isomeric SMILES

CCC1=NN=CN1C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C11H11N3O2/c1-2-10-13-12-7-14(10)9-6-4-3-5-8(9)11(15)16/h3-7H,2H2,1H3,(H,15,16)