ethyl 4,4-bis(ethylsulfanyl)-3-(trifluoromethyl)but-3-enoate

Systemtic Name: ethyl 4,4-bis(ethylsulfanyl)-3-(trifluoromethyl)but-3-enoate Openeye Name: ethyl 4,4-bis(ethylsulfanyl)-3-(trifluoromethyl)but-3-enoate CAS Name: 4,4-bis(ethylthio)-3-(trifluoromethyl)-3-butenoic acid ethyl ester IUPAC Name: ethyl 4,4-bis(ethylsulfanyl)-3-(trifluoromethyl)but-3-enoate Traditional Name: 4,4-bis(ethylthio)-3-(trifluoromethyl)but-3-enoic acid ethyl ester Formula: C11H17F3O2S2 MolecularWeight: 302.37669

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=C(SCC)SCC)C(F)(F)F

Isomeric SMILES

CCOC(=O)CC(=C(SCC)SCC)C(F)(F)F

InChI

InChI=1S/C11H17F3O2S2/c1-4-16-9(15)7-8(11(12,13)14)10(17-5-2)18-6-3/h4-7H2,1-3H3