methyl 2-(1,3-dithiolan-2-ylidene)-3,3,3-tris(fluoranyl)propanoate

Systemtic Name: methyl 2-(1,3-dithiolan-2-ylidene)-3,3,3-tris(fluoranyl)propanoate Openeye Name: methyl 2-(1,3-dithiolan-2-ylidene)-3,3,3-trifluoro-propanoate CAS Name: 2-(1,3-dithiolan-2-ylidene)-3,3,3-trifluoropropanoic acid methyl ester IUPAC Name: methyl 2-(1,3-dithiolan-2-ylidene)-3,3,3-trifluoropropanoate Traditional Name: 2-(1,3-dithiolan-2-ylidene)-3,3,3-trifluoro-propionic acid methyl ester Formula: C7H7F3O2S2 MolecularWeight: 244.25449

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C1SCCS1)C(F)(F)F

Isomeric SMILES

COC(=O)C(=C1SCCS1)C(F)(F)F

InChI

InChI=1S/C7H7F3O2S2/c1-12-5(11)4(7(8,9)10)6-13-2-3-14-6/h2-3H2,1H3