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

Systemtic Name: (2R,4R)-2-(2-ethoxyphenyl)-1,3-thiazolidin-3-ium-4-carboxylate Openeye Name: (2R,4R)-2-(2-ethoxyphenyl)thiazolidin-3-ium-4-carboxylate CAS Name: (2R,4R)-2-(2-ethoxyphenyl)-4-thiazolidin-3-iumcarboxylate IUPAC Name: (2R,4R)-2-(2-ethoxyphenyl)-1,3-thiazolidin-3-ium-4-carboxylate Traditional Name: (2R,4R)-2-o-phenetylthiazolidin-3-ium-4-carboxylate Formula: C12H15NO3S MolecularWeight: 253.3174

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2[NH2+]C(CS2)C(=O)[O-]

Isomeric SMILES

CCOC1=CC=CC=C1[C@@H]2[NH2+][C@@H](CS2)C(=O)[O-]

InChI

InChI=1S/C12H15NO3S/c1-2-16-10-6-4-3-5-8(10)11-13-9(7-17-11)12(14)15/h3-6,9,11,13H,2,7H2,1H3,(H,14,15)/t9-,11+/m0/s1