6-ethyloctan-3-yl (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate

Systemtic Name: 6-ethyloctan-3-yl (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate Openeye Name: 1,4-diethylhexyl (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate CAS Name: (E)-3-[3-(trifluoromethyl)phenyl]-2-propenoic acid 6-ethyloctan-3-yl ester IUPAC Name: 6-ethyloctan-3-yl (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate Traditional Name: (E)-3-[3-(trifluoromethyl)phenyl]acrylic acid 1,4-diethylhexyl ester Formula: C20H27F3O2 MolecularWeight: 356.42239

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CCC(CC)OC(=O)C=CC1=CC(=CC=C1)C(F)(F)F

Isomeric SMILES

CCC(CC)CCC(CC)OC(=O)/C=C/C1=CC(=CC=C1)C(F)(F)F

InChI

InChI=1S/C20H27F3O2/c1-4-15(5-2)10-12-18(6-3)25-19(24)13-11-16-8-7-9-17(14-16)20(21,22)23/h7-9,11,13-15,18H,4-6,10,12H2,1-3H3/b13-11+