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

Systemtic Name: (2R,4R)-2-(4-butoxyphenyl)-1,3-thiazolidin-3-ium-4-carboxylate Openeye Name: (2R,4R)-2-(4-butoxyphenyl)thiazolidin-3-ium-4-carboxylate CAS Name: (2R,4R)-2-(4-butoxyphenyl)-4-thiazolidin-3-iumcarboxylate IUPAC Name: (2R,4R)-2-(4-butoxyphenyl)-1,3-thiazolidin-3-ium-4-carboxylate Traditional Name: (2R,4R)-2-(4-butoxyphenyl)thiazolidin-3-ium-4-carboxylate Formula: C14H19NO3S MolecularWeight: 281.37056

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2[NH2+]C(CS2)C(=O)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)[C@@H]2[NH2+][C@@H](CS2)C(=O)[O-]

InChI

InChI=1S/C14H19NO3S/c1-2-3-8-18-11-6-4-10(5-7-11)13-15-12(9-19-13)14(16)17/h4-7,12-13,15H,2-3,8-9H2,1H3,(H,16,17)/t12-,13+/m0/s1