[2-(3-chlorophenyl)-5-propyl-pyrazol-3-yl] 2-ethylhexanoate

Systemtic Name: [2-(3-chlorophenyl)-5-propyl-pyrazol-3-yl] 2-ethylhexanoate Openeye Name: [2-(3-chlorophenyl)-5-propyl-pyrazol-3-yl] 2-ethylhexanoate CAS Name: 2-ethylhexanoic acid [2-(3-chlorophenyl)-5-propyl-3-pyrazolyl] ester IUPAC Name: [2-(3-chlorophenyl)-5-propylpyrazol-3-yl] 2-ethylhexanoate Traditional Name: 2-ethylhexanoic acid [2-(3-chlorophenyl)-5-propyl-pyrazol-3-yl] ester Formula: C20H27ClN2O2 MolecularWeight: 362.89358

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27ClN2O2/c1-4-7-10-15(6-3)20(24)25-19-14-17(9-5-2)22-23(19)18-12-8-11-16(21)13-18/h8,11-15H,4-7,9-10H2,1-3H3