methyl 4-[(2-phenyl-1,3-thiazolidin-3-ium-4-yl)carbonylamino]butanoate chloride

Systemtic Name: methyl 4-[(2-phenyl-1,3-thiazolidin-3-ium-4-yl)carbonylamino]butanoate chloride Openeye Name: methyl 4-[(2-phenylthiazolidin-3-ium-4-carbonyl)amino]butanoate chloride CAS Name: 4-[[oxo-(2-phenyl-4-thiazolidin-3-iumyl)methyl]amino]butanoic acid methyl ester chloride IUPAC Name: methyl 4-[(2-phenyl-1,3-thiazolidin-3-ium-4-carbonyl)amino]butanoate chloride Traditional Name: 4-[(2-phenylthiazolidin-3-ium-4-carbonyl)amino]butyric acid methyl ester chloride Formula: C15H21ClN2O3S MolecularWeight: 344.85684

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=O)C1CSC([NH2+]1)C2=CC=CC=C2.[Cl-]

Isomeric SMILES

COC(=O)CCCNC(=O)C1CSC([NH2+]1)C2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C15H20N2O3S.ClH/c1-20-13(18)8-5-9-16-14(19)12-10-21-15(17-12)11-6-3-2-4-7-11;/h2-4,6-7,12,15,17H,5,8-10H2,1H3,(H,16,19);1H