cyclohexyl 1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylate

Systemtic Name: cyclohexyl 1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylate Openeye Name: cyclohexyl 1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylate CAS Name: 1-[3-(trifluoromethyl)phenyl]-3-pyrazolecarboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl 1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylate Traditional Name: 1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylic acid cyclohexyl ester Formula: C17H17F3N2O2 MolecularWeight: 338.32429

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)C2=NN(C=C2)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1CCC(CC1)OC(=O)C2=NN(C=C2)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C17H17F3N2O2/c18-17(19,20)12-5-4-6-13(11-12)22-10-9-15(21-22)16(23)24-14-7-2-1-3-8-14/h4-6,9-11,14H,1-3,7-8H2