1-(3-fluoranyl-4-methoxy-phenyl)-5-propan-2-yl-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 1-(3-fluoranyl-4-methoxy-phenyl)-5-propan-2-yl-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-(3-fluoro-4-methoxy-phenyl)-5-isopropyl-triazole-4-carboxylic acid CAS Name: 1-(3-fluoro-4-methoxyphenyl)-5-propan-2-yl-4-triazolecarboxylic acid IUPAC Name: 1-(3-fluoro-4-methoxyphenyl)-5-propan-2-yltriazole-4-carboxylic acid Traditional Name: 1-(3-fluoro-4-methoxy-phenyl)-5-isopropyl-triazole-4-carboxylic acid Formula: C13H14FN3O3 MolecularWeight: 279.266963

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N=NN1C2=CC(=C(C=C2)OC)F)C(=O)O

Isomeric SMILES

CC(C)C1=C(N=NN1C2=CC(=C(C=C2)OC)F)C(=O)O

InChI

InChI=1S/C13H14FN3O3/c1-7(2)12-11(13(18)19)15-16-17(12)8-4-5-10(20-3)9(14)6-8/h4-7H,1-3H3,(H,18,19)