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

Systemtic Name: (2S,4R)-2-(4-acetamidophenyl)-1,3-thiazolidin-3-ium-4-carboxylate Openeye Name: (2S,4R)-2-(4-acetamidophenyl)thiazolidin-3-ium-4-carboxylate CAS Name: (2S,4R)-2-(4-acetamidophenyl)-4-thiazolidin-3-iumcarboxylate IUPAC Name: (2S,4R)-2-(4-acetamidophenyl)-1,3-thiazolidin-3-ium-4-carboxylate Traditional Name: (2S,4R)-2-(4-acetamidophenyl)thiazolidin-3-ium-4-carboxylate Formula: C12H14N2O3S MolecularWeight: 266.31616

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C2[NH2+]C(CS2)C(=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)[C@H]2[NH2+][C@@H](CS2)C(=O)[O-]

InChI

InChI=1S/C12H14N2O3S/c1-7(15)13-9-4-2-8(3-5-9)11-14-10(6-18-11)12(16)17/h2-5,10-11,14H,6H2,1H3,(H,13,15)(H,16,17)/t10-,11-/m0/s1