ethyl 1-[2-(2,5-dimethylphenyl)ethanoyloxy]-4-(trifluoromethyl)cyclohexane-1-carboxylate

Systemtic Name: ethyl 1-[2-(2,5-dimethylphenyl)ethanoyloxy]-4-(trifluoromethyl)cyclohexane-1-carboxylate Openeye Name: ethyl 1-[2-(2,5-dimethylphenyl)acetyl]oxy-4-(trifluoromethyl)cyclohexanecarboxylate CAS Name: 1-[2-(2,5-dimethylphenyl)-1-oxoethoxy]-4-(trifluoromethyl)-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(2,5-dimethylphenyl)acetyl]oxy-4-(trifluoromethyl)cyclohexane-1-carboxylate Traditional Name: 1-[2-(2,5-dimethylphenyl)acetyl]oxy-4-(trifluoromethyl)cyclohexanecarboxylic acid ethyl ester Formula: C20H25F3O4 MolecularWeight: 386.40531

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCC(CC1)C(F)(F)F)OC(=O)CC2=C(C=CC(=C2)C)C

Isomeric SMILES

CCOC(=O)C1(CCC(CC1)C(F)(F)F)OC(=O)CC2=C(C=CC(=C2)C)C

InChI

InChI=1S/C20H25F3O4/c1-4-26-18(25)19(9-7-16(8-10-19)20(21,22)23)27-17(24)12-15-11-13(2)5-6-14(15)3/h5-6,11,16H,4,7-10,12H2,1-3H3