methyl (2S,4S)-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-ium-4-carboxylate

Systemtic Name: methyl (2S,4S)-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-ium-4-carboxylate Openeye Name: methyl (2S,4S)-2-[4-(trifluoromethyl)phenyl]thiazolidin-3-ium-4-carboxylate CAS Name: (2S,4S)-2-[4-(trifluoromethyl)phenyl]-4-thiazolidin-3-iumcarboxylic acid methyl ester IUPAC Name: methyl (2S,4S)-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-ium-4-carboxylate Traditional Name: (2S,4S)-2-[4-(trifluoromethyl)phenyl]thiazolidin-3-ium-4-carboxylic acid methyl ester Formula: C12H13F3NO2S+ MolecularWeight: 292.29733

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CSC([NH2+]1)C2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

COC(=O)[C@H]1CS[C@H]([NH2+]1)C2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C12H12F3NO2S/c1-18-11(17)9-6-19-10(16-9)7-2-4-8(5-3-7)12(13,14)15/h2-5,9-10,16H,6H2,1H3/p+1/t9-,10+/m1/s1