5-cyclopropyl-1-(4-fluoranyl-2-methyl-phenyl)-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 5-cyclopropyl-1-(4-fluoranyl-2-methyl-phenyl)-1,2,3-triazole-4-carboxylic acid Openeye Name: 5-cyclopropyl-1-(4-fluoro-2-methyl-phenyl)triazole-4-carboxylic acid CAS Name: 5-cyclopropyl-1-(4-fluoro-2-methylphenyl)-4-triazolecarboxylic acid IUPAC Name: 5-cyclopropyl-1-(4-fluoro-2-methylphenyl)triazole-4-carboxylic acid Traditional Name: 5-cyclopropyl-1-(4-fluoro-2-methyl-phenyl)triazole-4-carboxylic acid Formula: C13H12FN3O2 MolecularWeight: 261.251683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)N2C(=C(N=N2)C(=O)O)C3CC3

Isomeric SMILES

CC1=C(C=CC(=C1)F)N2C(=C(N=N2)C(=O)O)C3CC3

InChI

InChI=1S/C13H12FN3O2/c1-7-6-9(14)4-5-10(7)17-12(8-2-3-8)11(13(18)19)15-16-17/h4-6,8H,2-3H2,1H3,(H,18,19)