1-(6-methoxypyridin-3-yl)-5-(4-methylphenyl)-1,2,4-triazole-3-carboxylic acid

Systemtic Name: 1-(6-methoxypyridin-3-yl)-5-(4-methylphenyl)-1,2,4-triazole-3-carboxylic acid Openeye Name: 1-(6-methoxy-3-pyridyl)-5-(p-tolyl)-1,2,4-triazole-3-carboxylic acid CAS Name: 1-(6-methoxy-3-pyridinyl)-5-(4-methylphenyl)-1,2,4-triazole-3-carboxylic acid IUPAC Name: 1-(6-methoxypyridin-3-yl)-5-(4-methylphenyl)-1,2,4-triazole-3-carboxylic acid Traditional Name: 1-(6-methoxy-3-pyridyl)-5-(p-tolyl)-1,2,4-triazole-3-carboxylic acid Formula: C16H14N4O3 MolecularWeight: 310.30736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NN2C3=CN=C(C=C3)OC)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NN2C3=CN=C(C=C3)OC)C(=O)O

InChI

InChI=1S/C16H14N4O3/c1-10-3-5-11(6-4-10)15-18-14(16(21)22)19-20(15)12-7-8-13(23-2)17-9-12/h3-9H,1-2H3,(H,21,22)