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

Systemtic Name: (2R,4R)-2-(4-methoxycarbonylphenyl)-1,3-thiazolidin-3-ium-4-carboxylate Openeye Name: (2R,4R)-2-(4-methoxycarbonylphenyl)thiazolidin-3-ium-4-carboxylate CAS Name: (2R,4R)-2-(4-methoxycarbonylphenyl)-4-thiazolidin-3-iumcarboxylate IUPAC Name: (2R,4R)-2-(4-methoxycarbonylphenyl)-1,3-thiazolidin-3-ium-4-carboxylate Traditional Name: (2R,4R)-2-(4-carbomethoxyphenyl)thiazolidin-3-ium-4-carboxylate Formula: C12H13NO4S MolecularWeight: 267.30092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO4S/c1-17-12(16)8-4-2-7(3-5-8)10-13-9(6-18-10)11(14)15/h2-5,9-10,13H,6H2,1H3,(H,14,15)/t9-,10+/m0/s1