(Z)-3-[4-(4-methylphenyl)-5-pyridin-2-yl-1,2,4-triazol-3-yl]prop-2-enoic acid

Systemtic Name: (Z)-3-[4-(4-methylphenyl)-5-pyridin-2-yl-1,2,4-triazol-3-yl]prop-2-enoic acid Openeye Name: (Z)-3-[4-(p-tolyl)-5-(2-pyridyl)-1,2,4-triazol-3-yl]prop-2-enoic acid CAS Name: (Z)-3-[4-(4-methylphenyl)-5-(2-pyridinyl)-1,2,4-triazol-3-yl]-2-propenoic acid IUPAC Name: (Z)-3-[4-(4-methylphenyl)-5-pyridin-2-yl-1,2,4-triazol-3-yl]prop-2-enoic acid Traditional Name: (Z)-3-[4-(p-tolyl)-5-(2-pyridyl)-1,2,4-triazol-3-yl]acrylic acid Formula: C17H14N4O2 MolecularWeight: 306.31866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2C3=CC=CC=N3)C=CC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2C3=CC=CC=N3)/C=C\C(=O)O

InChI

InChI=1S/C17H14N4O2/c1-12-5-7-13(8-6-12)21-15(9-10-16(22)23)19-20-17(21)14-4-2-3-11-18-14/h2-11H,1H3,(H,22,23)/b10-9-