methyl 4-(5-phenyl-1,2,3-triazol-1-yl)benzoate

Systemtic Name: methyl 4-(5-phenyl-1,2,3-triazol-1-yl)benzoate Openeye Name: methyl 4-(5-phenyltriazol-1-yl)benzoate CAS Name: 4-(5-phenyl-1-triazolyl)benzoic acid methyl ester IUPAC Name: methyl 4-(5-phenyltriazol-1-yl)benzoate Traditional Name: 4-(5-phenyltriazol-1-yl)benzoic acid methyl ester Formula: C16H13N3O2 MolecularWeight: 279.29332

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)N2C(=CN=N2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)N2C(=CN=N2)C3=CC=CC=C3

InChI

InChI=1S/C16H13N3O2/c1-21-16(20)13-7-9-14(10-8-13)19-15(11-17-18-19)12-5-3-2-4-6-12/h2-11H,1H3