(4-cyano-2-methoxy-phenyl) 2-phenyl-1,2,3-triazole-4-carboxylate

Systemtic Name: (4-cyano-2-methoxy-phenyl) 2-phenyl-1,2,3-triazole-4-carboxylate Openeye Name: (4-cyano-2-methoxy-phenyl) 2-phenyltriazole-4-carboxylate CAS Name: 2-phenyl-4-triazolecarboxylic acid (4-cyano-2-methoxyphenyl) ester IUPAC Name: (4-cyano-2-methoxyphenyl) 2-phenyltriazole-4-carboxylate Traditional Name: 2-phenyltriazole-4-carboxylic acid (4-cyano-2-methoxy-phenyl) ester Formula: C17H12N4O3 MolecularWeight: 320.30218

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C#N)OC(=O)C2=NN(N=C2)C3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)C#N)OC(=O)C2=NN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C17H12N4O3/c1-23-16-9-12(10-18)7-8-15(16)24-17(22)14-11-19-21(20-14)13-5-3-2-4-6-13/h2-9,11H,1H3