[4-(2-cyanophenyl)phenyl]methyl 1,3,5-trimethylpyrazole-4-carboxylate

Systemtic Name: [4-(2-cyanophenyl)phenyl]methyl 1,3,5-trimethylpyrazole-4-carboxylate Openeye Name: [4-(2-cyanophenyl)phenyl]methyl 1,3,5-trimethylpyrazole-4-carboxylate CAS Name: 1,3,5-trimethyl-4-pyrazolecarboxylic acid [4-(2-cyanophenyl)phenyl]methyl ester IUPAC Name: [4-(2-cyanophenyl)phenyl]methyl 1,3,5-trimethylpyrazole-4-carboxylate Traditional Name: 1,3,5-trimethylpyrazole-4-carboxylic acid [4-(2-cyanophenyl)benzyl] ester Formula: C21H19N3O2 MolecularWeight: 345.39446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C(=O)OCC2=CC=C(C=C2)C3=CC=CC=C3C#N

Isomeric SMILES

CC1=C(C(=NN1C)C)C(=O)OCC2=CC=C(C=C2)C3=CC=CC=C3C#N

InChI

InChI=1S/C21H19N3O2/c1-14-20(15(2)24(3)23-14)21(25)26-13-16-8-10-17(11-9-16)19-7-5-4-6-18(19)12-22/h4-11H,13H2,1-3H3