[2-(2-chlorophenyl)-5-propan-2-yl-pyrazol-3-yl] 3,5,5-trimethylhexanoate

Systemtic Name: [2-(2-chlorophenyl)-5-propan-2-yl-pyrazol-3-yl] 3,5,5-trimethylhexanoate Openeye Name: [2-(2-chlorophenyl)-5-isopropyl-pyrazol-3-yl] 3,5,5-trimethylhexanoate CAS Name: 3,5,5-trimethylhexanoic acid [2-(2-chlorophenyl)-5-propan-2-yl-3-pyrazolyl] ester IUPAC Name: [2-(2-chlorophenyl)-5-propan-2-ylpyrazol-3-yl] 3,5,5-trimethylhexanoate Traditional Name: 3,5,5-trimethylhexanoic acid [2-(2-chlorophenyl)-5-isopropyl-pyrazol-3-yl] ester Formula: C21H29ClN2O2 MolecularWeight: 376.92016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN(C(=C1)OC(=O)CC(C)CC(C)(C)C)C2=CC=CC=C2Cl

Isomeric SMILES

CC(C)C1=NN(C(=C1)OC(=O)CC(C)CC(C)(C)C)C2=CC=CC=C2Cl

InChI

InChI=1S/C21H29ClN2O2/c1-14(2)17-12-19(24(23-17)18-10-8-7-9-16(18)22)26-20(25)11-15(3)13-21(4,5)6/h7-10,12,14-15H,11,13H2,1-6H3