(2R,4R)-2-(3-methoxy-4-phenylmethoxy-phenyl)-1,3-thiazolidin-3-ium-4-carboxylate

Systemtic Name: (2R,4R)-2-(3-methoxy-4-phenylmethoxy-phenyl)-1,3-thiazolidin-3-ium-4-carboxylate Openeye Name: (2R,4R)-2-(4-benzyloxy-3-methoxy-phenyl)thiazolidin-3-ium-4-carboxylate CAS Name: (2R,4R)-2-(3-methoxy-4-phenylmethoxyphenyl)-4-thiazolidin-3-iumcarboxylate IUPAC Name: (2R,4R)-2-(3-methoxy-4-phenylmethoxyphenyl)-1,3-thiazolidin-3-ium-4-carboxylate Traditional Name: (2R,4R)-2-(4-benzoxy-3-methoxy-phenyl)thiazolidin-3-ium-4-carboxylate Formula: C18H19NO4S MolecularWeight: 345.41276

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2[NH2+]C(CS2)C(=O)[O-])OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)[C@@H]2[NH2+][C@@H](CS2)C(=O)[O-])OCC3=CC=CC=C3

InChI

InChI=1S/C18H19NO4S/c1-22-16-9-13(17-19-14(11-24-17)18(20)21)7-8-15(16)23-10-12-5-3-2-4-6-12/h2-9,14,17,19H,10-11H2,1H3,(H,20,21)/t14-,17+/m0/s1