[2-(2-methylphenyl)-5-propyl-pyrazol-3-yl] benzoate

Systemtic Name: [2-(2-methylphenyl)-5-propyl-pyrazol-3-yl] benzoate Openeye Name: [2-(o-tolyl)-5-propyl-pyrazol-3-yl] benzoate CAS Name: benzoic acid [2-(2-methylphenyl)-5-propyl-3-pyrazolyl] ester IUPAC Name: [2-(2-methylphenyl)-5-propylpyrazol-3-yl] benzoate Traditional Name: benzoic acid [2-(o-tolyl)-5-propyl-pyrazol-3-yl] ester Formula: C20H20N2O2 MolecularWeight: 320.385

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1)OC(=O)C2=CC=CC=C2)C3=CC=CC=C3C

Isomeric SMILES

CCCC1=NN(C(=C1)OC(=O)C2=CC=CC=C2)C3=CC=CC=C3C

InChI

InChI=1S/C20H20N2O2/c1-3-9-17-14-19(24-20(23)16-11-5-4-6-12-16)22(21-17)18-13-8-7-10-15(18)2/h4-8,10-14H,3,9H2,1-2H3