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

Systemtic Name: [2-(4-methylphenyl)-5-propan-2-yl-pyrazol-3-yl] 2-ethylhexanoate Openeye Name: [5-isopropyl-2-(p-tolyl)pyrazol-3-yl] 2-ethylhexanoate CAS Name: 2-ethylhexanoic acid [2-(4-methylphenyl)-5-propan-2-yl-3-pyrazolyl] ester IUPAC Name: [2-(4-methylphenyl)-5-propan-2-ylpyrazol-3-yl] 2-ethylhexanoate Traditional Name: 2-ethylhexanoic acid [5-isopropyl-2-(p-tolyl)pyrazol-3-yl] ester Formula: C21H30N2O2 MolecularWeight: 342.4751

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H30N2O2/c1-6-8-9-17(7-2)21(24)25-20-14-19(15(3)4)22-23(20)18-12-10-16(5)11-13-18/h10-15,17H,6-9H2,1-5H3