methyl 4-[4-(4-fluorophenyl)-5-pyridin-4-yl-1,2,3-triazol-1-yl]benzoate

Systemtic Name: methyl 4-[4-(4-fluorophenyl)-5-pyridin-4-yl-1,2,3-triazol-1-yl]benzoate Openeye Name: methyl 4-[4-(4-fluorophenyl)-5-(4-pyridyl)triazol-1-yl]benzoate CAS Name: 4-[4-(4-fluorophenyl)-5-pyridin-4-yl-1-triazolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-(4-fluorophenyl)-5-pyridin-4-yltriazol-1-yl]benzoate Traditional Name: 4-[4-(4-fluorophenyl)-5-(4-pyridyl)triazol-1-yl]benzoic acid methyl ester Formula: C21H15FN4O2 MolecularWeight: 374.367803

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)N2C(=C(N=N2)C3=CC=C(C=C3)F)C4=CC=NC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)N2C(=C(N=N2)C3=CC=C(C=C3)F)C4=CC=NC=C4

InChI

InChI=1S/C21H15FN4O2/c1-28-21(27)16-4-8-18(9-5-16)26-20(15-10-12-23-13-11-15)19(24-25-26)14-2-6-17(22)7-3-14/h2-13H,1H3