(3-cyanophenyl)methyl 5-methyl-2-phenyl-1,2,3-triazole-4-carboxylate

Systemtic Name: (3-cyanophenyl)methyl 5-methyl-2-phenyl-1,2,3-triazole-4-carboxylate Openeye Name: (3-cyanophenyl)methyl 5-methyl-2-phenyl-triazole-4-carboxylate CAS Name: 5-methyl-2-phenyl-4-triazolecarboxylic acid (3-cyanophenyl)methyl ester IUPAC Name: (3-cyanophenyl)methyl 5-methyl-2-phenyltriazole-4-carboxylate Traditional Name: 5-methyl-2-phenyl-triazole-4-carboxylic acid (3-cyanobenzyl) ester Formula: C18H14N4O2 MolecularWeight: 318.32936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)OCC2=CC=CC(=C2)C#N)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(N=C1C(=O)OCC2=CC=CC(=C2)C#N)C3=CC=CC=C3

InChI

InChI=1S/C18H14N4O2/c1-13-17(21-22(20-13)16-8-3-2-4-9-16)18(23)24-12-15-7-5-6-14(10-15)11-19/h2-10H,12H2,1H3