[2-(4-methylphenyl)-5-phenyl-pyrazol-3-yl] hexanoate

Systemtic Name: [2-(4-methylphenyl)-5-phenyl-pyrazol-3-yl] hexanoate Openeye Name: [5-phenyl-2-(p-tolyl)pyrazol-3-yl] hexanoate CAS Name: hexanoic acid [2-(4-methylphenyl)-5-phenyl-3-pyrazolyl] ester IUPAC Name: [2-(4-methylphenyl)-5-phenylpyrazol-3-yl] hexanoate Traditional Name: hexanoic acid [5-phenyl-2-(p-tolyl)pyrazol-3-yl] ester Formula: C22H24N2O2 MolecularWeight: 348.43816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC1=CC(=NN1C2=CC=C(C=C2)C)C3=CC=CC=C3

Isomeric SMILES

CCCCCC(=O)OC1=CC(=NN1C2=CC=C(C=C2)C)C3=CC=CC=C3

InChI

InChI=1S/C22H24N2O2/c1-3-4-6-11-22(25)26-21-16-20(18-9-7-5-8-10-18)23-24(21)19-14-12-17(2)13-15-19/h5,7-10,12-16H,3-4,6,11H2,1-2H3