(phenylmethyl) 1-phenyl-3-pyridin-3-yl-pyrazole-4-carboxylate

Systemtic Name: (phenylmethyl) 1-phenyl-3-pyridin-3-yl-pyrazole-4-carboxylate Openeye Name: benzyl 1-phenyl-3-(3-pyridyl)pyrazole-4-carboxylate CAS Name: 1-phenyl-3-(3-pyridinyl)-4-pyrazolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-phenyl-3-pyridin-3-ylpyrazole-4-carboxylate Traditional Name: 1-phenyl-3-(3-pyridyl)pyrazole-4-carboxylic acid benzyl ester Formula: C22H17N3O2 MolecularWeight: 355.38928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H17N3O2/c26-22(27-16-17-8-3-1-4-9-17)20-15-25(19-11-5-2-6-12-19)24-21(20)18-10-7-13-23-14-18/h1-15H,16H2