2-(3-cyclopropyl-5-methyl-1,2,4-triazol-4-yl)benzoic acid

Systemtic Name: 2-(3-cyclopropyl-5-methyl-1,2,4-triazol-4-yl)benzoic acid Openeye Name: 2-(3-cyclopropyl-5-methyl-1,2,4-triazol-4-yl)benzoic acid CAS Name: 2-(3-cyclopropyl-5-methyl-1,2,4-triazol-4-yl)benzoic acid IUPAC Name: 2-(3-cyclopropyl-5-methyl-1,2,4-triazol-4-yl)benzoic acid Traditional Name: 2-(3-cyclopropyl-5-methyl-1,2,4-triazol-4-yl)benzoic acid Formula: C13H13N3O2 MolecularWeight: 243.26122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2=CC=CC=C2C(=O)O)C3CC3

Isomeric SMILES

CC1=NN=C(N1C2=CC=CC=C2C(=O)O)C3CC3

InChI

InChI=1S/C13H13N3O2/c1-8-14-15-12(9-6-7-9)16(8)11-5-3-2-4-10(11)13(17)18/h2-5,9H,6-7H2,1H3,(H,17,18)