methyl 4-methoxy-3-octyl-6-oxidanyl-2-oxidanylidene-6-(trifluoromethyl)cyclohex-3-ene-1-carboxylate

Systemtic Name: methyl 4-methoxy-3-octyl-6-oxidanyl-2-oxidanylidene-6-(trifluoromethyl)cyclohex-3-ene-1-carboxylate Openeye Name: methyl 6-hydroxy-4-methoxy-3-octyl-2-oxo-6-(trifluoromethyl)cyclohex-3-ene-1-carboxylate CAS Name: 6-hydroxy-4-methoxy-3-octyl-2-oxo-6-(trifluoromethyl)-1-cyclohex-3-enecarboxylic acid methyl ester IUPAC Name: methyl 6-hydroxy-4-methoxy-3-octyl-2-oxo-6-(trifluoromethyl)cyclohex-3-ene-1-carboxylate Traditional Name: 6-hydroxy-2-keto-4-methoxy-3-octyl-6-(trifluoromethyl)cyclohex-3-ene-1-carboxylic acid methyl ester Formula: C18H27F3O5 MolecularWeight: 380.39919

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(CC(C(C1=O)C(=O)OC)(C(F)(F)F)O)OC

Isomeric SMILES

CCCCCCCCC1=C(CC(C(C1=O)C(=O)OC)(C(F)(F)F)O)OC

InChI

InChI=1S/C18H27F3O5/c1-4-5-6-7-8-9-10-12-13(25-2)11-17(24,18(19,20)21)14(15(12)22)16(23)26-3/h14,24H,4-11H2,1-3H3