5-(4-fluoranylphenoxy)-1-[(4-methoxyphenyl)methyl]-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 5-(4-fluoranylphenoxy)-1-[(4-methoxyphenyl)methyl]-1,2,3-triazole-4-carboxylic acid Openeye Name: 5-(4-fluorophenoxy)-1-[(4-methoxyphenyl)methyl]triazole-4-carboxylic acid CAS Name: 5-(4-fluorophenoxy)-1-[(4-methoxyphenyl)methyl]-4-triazolecarboxylic acid IUPAC Name: 5-(4-fluorophenoxy)-1-[(4-methoxyphenyl)methyl]triazole-4-carboxylic acid Traditional Name: 5-(4-fluorophenoxy)-1-p-anisyl-triazole-4-carboxylic acid Formula: C17H14FN3O4 MolecularWeight: 343.309163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=C(N=N2)C(=O)O)OC3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=C(N=N2)C(=O)O)OC3=CC=C(C=C3)F

InChI

InChI=1S/C17H14FN3O4/c1-24-13-6-2-11(3-7-13)10-21-16(15(17(22)23)19-20-21)25-14-8-4-12(18)5-9-14/h2-9H,10H2,1H3,(H,22,23)