methyl 2-[4-(diethylamino)phenyl]sulfanyl-3,3,3-tris(fluoranyl)-2-(trifluoromethyl)propanoate

Systemtic Name: methyl 2-[4-(diethylamino)phenyl]sulfanyl-3,3,3-tris(fluoranyl)-2-(trifluoromethyl)propanoate Openeye Name: methyl 2-[4-(diethylamino)phenyl]sulfanyl-3,3,3-trifluoro-2-(trifluoromethyl)propanoate CAS Name: 2-[[4-(diethylamino)phenyl]thio]-3,3,3-trifluoro-2-(trifluoromethyl)propanoic acid methyl ester IUPAC Name: methyl 2-[4-(diethylamino)phenyl]sulfanyl-3,3,3-trifluoro-2-(trifluoromethyl)propanoate Traditional Name: 2-[[4-(diethylamino)phenyl]thio]-3,3,3-trifluoro-2-(trifluoromethyl)propionic acid methyl ester Formula: C15H17F6NO2S MolecularWeight: 389.356399

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)SC(C(=O)OC)(C(F)(F)F)C(F)(F)F

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)SC(C(=O)OC)(C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C15H17F6NO2S/c1-4-22(5-2)10-6-8-11(9-7-10)25-13(12(23)24-3,14(16,17)18)15(19,20)21/h6-9H,4-5H2,1-3H3