propyl 3-oxidanylidene-4-(trifluoromethyl)thiolane-2-carboxylate

Systemtic Name: propyl 3-oxidanylidene-4-(trifluoromethyl)thiolane-2-carboxylate Openeye Name: propyl 3-oxo-4-(trifluoromethyl)tetrahydrothiophene-2-carboxylate CAS Name: 3-oxo-4-(trifluoromethyl)-2-thiolanecarboxylic acid propyl ester IUPAC Name: propyl 3-oxo-4-(trifluoromethyl)thiolane-2-carboxylate Traditional Name: 3-keto-4-(trifluoromethyl)tetrahydrothiophene-2-carboxylic acid propyl ester Formula: C9H11F3O3S MolecularWeight: 256.24205

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1C(=O)C(CS1)C(F)(F)F

Isomeric SMILES

CCCOC(=O)C1C(=O)C(CS1)C(F)(F)F

InChI

InChI=1S/C9H11F3O3S/c1-2-3-15-8(14)7-6(13)5(4-16-7)9(10,11)12/h5,7H,2-4H2,1H3