(2R,4R)-2-(2,5-dimethoxyphenyl)-1,3-thiazolidin-3-ium-4-carboxylate

Systemtic Name: (2R,4R)-2-(2,5-dimethoxyphenyl)-1,3-thiazolidin-3-ium-4-carboxylate Openeye Name: (2R,4R)-2-(2,5-dimethoxyphenyl)thiazolidin-3-ium-4-carboxylate CAS Name: (2R,4R)-2-(2,5-dimethoxyphenyl)-4-thiazolidin-3-iumcarboxylate IUPAC Name: (2R,4R)-2-(2,5-dimethoxyphenyl)-1,3-thiazolidin-3-ium-4-carboxylate Traditional Name: (2R,4R)-2-(2,5-dimethoxyphenyl)thiazolidin-3-ium-4-carboxylate Formula: C12H15NO4S MolecularWeight: 269.3168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2[NH2+]C(CS2)C(=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)OC)[C@@H]2[NH2+][C@@H](CS2)C(=O)[O-]

InChI

InChI=1S/C12H15NO4S/c1-16-7-3-4-10(17-2)8(5-7)11-13-9(6-18-11)12(14)15/h3-5,9,11,13H,6H2,1-2H3,(H,14,15)/t9-,11+/m0/s1