[4-(trifluoromethyl)phenyl] 4-heptylcyclohexane-1-carboxylate

Systemtic Name: [4-(trifluoromethyl)phenyl] 4-heptylcyclohexane-1-carboxylate Openeye Name: [4-(trifluoromethyl)phenyl] 4-heptylcyclohexanecarboxylate CAS Name: 4-heptyl-1-cyclohexanecarboxylic acid [4-(trifluoromethyl)phenyl] ester IUPAC Name: [4-(trifluoromethyl)phenyl] 4-heptylcyclohexane-1-carboxylate Traditional Name: 4-heptylcyclohexanecarboxylic acid [4-(trifluoromethyl)phenyl] ester Formula: C21H29F3O2 MolecularWeight: 370.44897

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)C(=O)OC2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CCCCCCCC1CCC(CC1)C(=O)OC2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C21H29F3O2/c1-2-3-4-5-6-7-16-8-10-17(11-9-16)20(25)26-19-14-12-18(13-15-19)21(22,23)24/h12-17H,2-11H2,1H3