[2-(2-chlorophenyl)-5-propan-2-yl-pyrazol-3-yl] 4-hexylbenzoate

Systemtic Name: [2-(2-chlorophenyl)-5-propan-2-yl-pyrazol-3-yl] 4-hexylbenzoate Openeye Name: [2-(2-chlorophenyl)-5-isopropyl-pyrazol-3-yl] 4-hexylbenzoate CAS Name: 4-hexylbenzoic acid [2-(2-chlorophenyl)-5-propan-2-yl-3-pyrazolyl] ester IUPAC Name: [2-(2-chlorophenyl)-5-propan-2-ylpyrazol-3-yl] 4-hexylbenzoate Traditional Name: 4-hexylbenzoic acid [2-(2-chlorophenyl)-5-isopropyl-pyrazol-3-yl] ester Formula: C25H29ClN2O2 MolecularWeight: 424.96296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)OC2=CC(=NN2C3=CC=CC=C3Cl)C(C)C

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)OC2=CC(=NN2C3=CC=CC=C3Cl)C(C)C

InChI

InChI=1S/C25H29ClN2O2/c1-4-5-6-7-10-19-13-15-20(16-14-19)25(29)30-24-17-22(18(2)3)27-28(24)23-12-9-8-11-21(23)26/h8-9,11-18H,4-7,10H2,1-3H3