(2S,4S)-2-(2,4-dichlorophenyl)-5,5-dimethyl-1,3-thiazolidin-3-ium-4-carboxylate

Systemtic Name: (2S,4S)-2-(2,4-dichlorophenyl)-5,5-dimethyl-1,3-thiazolidin-3-ium-4-carboxylate Openeye Name: (2S,4S)-2-(2,4-dichlorophenyl)-5,5-dimethyl-thiazolidin-3-ium-4-carboxylate CAS Name: (2S,4S)-2-(2,4-dichlorophenyl)-5,5-dimethyl-4-thiazolidin-3-iumcarboxylate IUPAC Name: (2S,4S)-2-(2,4-dichlorophenyl)-5,5-dimethyl-1,3-thiazolidin-3-ium-4-carboxylate Traditional Name: (2S,4S)-2-(2,4-dichlorophenyl)-5,5-dimethyl-thiazolidin-3-ium-4-carboxylate Formula: C12H13Cl2NO2S MolecularWeight: 306.20812

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C([NH2+]C(S1)C2=C(C=C(C=C2)Cl)Cl)C(=O)[O-])C

Isomeric SMILES

CC1([C@@H]([NH2+][C@@H](S1)C2=C(C=C(C=C2)Cl)Cl)C(=O)[O-])C

InChI

InChI=1S/C12H13Cl2NO2S/c1-12(2)9(11(16)17)15-10(18-12)7-4-3-6(13)5-8(7)14/h3-5,9-10,15H,1-2H3,(H,16,17)/t9-,10-/m0/s1