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

Systemtic Name: [2-(4-methylphenyl)-5-phenyl-pyrazol-3-yl] 2-ethylhexanoate Openeye Name: [5-phenyl-2-(p-tolyl)pyrazol-3-yl] 2-ethylhexanoate CAS Name: 2-ethylhexanoic acid [2-(4-methylphenyl)-5-phenyl-3-pyrazolyl] ester IUPAC Name: [2-(4-methylphenyl)-5-phenylpyrazol-3-yl] 2-ethylhexanoate Traditional Name: 2-ethylhexanoic acid [5-phenyl-2-(p-tolyl)pyrazol-3-yl] ester Formula: C24H28N2O2 MolecularWeight: 376.49132

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H28N2O2/c1-4-6-10-19(5-2)24(27)28-23-17-22(20-11-8-7-9-12-20)25-26(23)21-15-13-18(3)14-16-21/h7-9,11-17,19H,4-6,10H2,1-3H3