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

Systemtic Name: 2-(3-propan-2-yl-1,2,4-triazol-4-yl)benzoic acid Openeye Name: 2-(3-isopropyl-1,2,4-triazol-4-yl)benzoic acid CAS Name: 2-(3-propan-2-yl-1,2,4-triazol-4-yl)benzoic acid IUPAC Name: 2-(3-propan-2-yl-1,2,4-triazol-4-yl)benzoic acid Traditional Name: 2-(3-isopropyl-1,2,4-triazol-4-yl)benzoic acid Formula: C12H13N3O2 MolecularWeight: 231.25052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=CN1C2=CC=CC=C2C(=O)O

Isomeric SMILES

CC(C)C1=NN=CN1C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C12H13N3O2/c1-8(2)11-14-13-7-15(11)10-6-4-3-5-9(10)12(16)17/h3-8H,1-2H3,(H,16,17)