propan-2-yl (2S,4S)-2-phenyl-1,3-thiazolidin-3-ium-4-carboxylate

Systemtic Name: propan-2-yl (2S,4S)-2-phenyl-1,3-thiazolidin-3-ium-4-carboxylate Openeye Name: isopropyl (2S,4S)-2-phenylthiazolidin-3-ium-4-carboxylate CAS Name: (2S,4S)-2-phenyl-4-thiazolidin-3-iumcarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl (2S,4S)-2-phenyl-1,3-thiazolidin-3-ium-4-carboxylate Traditional Name: (2S,4S)-2-phenylthiazolidin-3-ium-4-carboxylic acid isopropyl ester Formula: C13H18NO2S+ MolecularWeight: 252.35252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1CSC([NH2+]1)C2=CC=CC=C2

Isomeric SMILES

CC(C)OC(=O)[C@H]1CS[C@H]([NH2+]1)C2=CC=CC=C2

InChI

InChI=1S/C13H17NO2S/c1-9(2)16-13(15)11-8-17-12(14-11)10-6-4-3-5-7-10/h3-7,9,11-12,14H,8H2,1-2H3/p+1/t11-,12+/m1/s1