(3-cyanophenyl)methyl 1,3-diphenylpyrazole-4-carboxylate

Systemtic Name: (3-cyanophenyl)methyl 1,3-diphenylpyrazole-4-carboxylate Openeye Name: (3-cyanophenyl)methyl 1,3-diphenylpyrazole-4-carboxylate CAS Name: 1,3-diphenyl-4-pyrazolecarboxylic acid (3-cyanophenyl)methyl ester IUPAC Name: (3-cyanophenyl)methyl 1,3-diphenylpyrazole-4-carboxylate Traditional Name: 1,3-diphenylpyrazole-4-carboxylic acid (3-cyanobenzyl) ester Formula: C24H17N3O2 MolecularWeight: 379.41068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2C(=O)OCC3=CC=CC(=C3)C#N)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2C(=O)OCC3=CC=CC(=C3)C#N)C4=CC=CC=C4

InChI

InChI=1S/C24H17N3O2/c25-15-18-8-7-9-19(14-18)17-29-24(28)22-16-27(21-12-5-2-6-13-21)26-23(22)20-10-3-1-4-11-20/h1-14,16H,17H2