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

Systemtic Name: (2S,4S)-2-(4-acetamidophenyl)-5,5-dimethyl-1,3-thiazolidin-3-ium-4-carboxylate Openeye Name: (2S,4S)-2-(4-acetamidophenyl)-5,5-dimethyl-thiazolidin-3-ium-4-carboxylate CAS Name: (2S,4S)-2-(4-acetamidophenyl)-5,5-dimethyl-4-thiazolidin-3-iumcarboxylate IUPAC Name: (2S,4S)-2-(4-acetamidophenyl)-5,5-dimethyl-1,3-thiazolidin-3-ium-4-carboxylate Traditional Name: (2S,4S)-2-(4-acetamidophenyl)-5,5-dimethyl-thiazolidin-3-ium-4-carboxylate Formula: C14H18N2O3S MolecularWeight: 294.36932

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C2[NH2+]C(C(S2)(C)C)C(=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)[C@H]2[NH2+][C@H](C(S2)(C)C)C(=O)[O-]

InChI

InChI=1S/C14H18N2O3S/c1-8(17)15-10-6-4-9(5-7-10)12-16-11(13(18)19)14(2,3)20-12/h4-7,11-12,16H,1-3H3,(H,15,17)(H,18,19)/t11-,12-/m0/s1