(2S,4S)-2-(2,4-dimethylphenyl)-1,3-thiazolidin-3-ium-4-carboxylate

Systemtic Name: (2S,4S)-2-(2,4-dimethylphenyl)-1,3-thiazolidin-3-ium-4-carboxylate Openeye Name: (2S,4S)-2-(2,4-dimethylphenyl)thiazolidin-3-ium-4-carboxylate CAS Name: (2S,4S)-2-(2,4-dimethylphenyl)-4-thiazolidin-3-iumcarboxylate IUPAC Name: (2S,4S)-2-(2,4-dimethylphenyl)-1,3-thiazolidin-3-ium-4-carboxylate Traditional Name: (2S,4S)-2-(2,4-dimethylphenyl)thiazolidin-3-ium-4-carboxylate Formula: C12H15NO2S MolecularWeight: 237.318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2[NH2+]C(CS2)C(=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)[C@H]2[NH2+][C@H](CS2)C(=O)[O-])C

InChI

InChI=1S/C12H15NO2S/c1-7-3-4-9(8(2)5-7)11-13-10(6-16-11)12(14)15/h3-5,10-11,13H,6H2,1-2H3,(H,14,15)/t10-,11+/m1/s1