2-[2-[2-(4-acetyloxyphenyl)-4-oxidanylidene-1,3-thiazolidin-3-yl]ethyl]-2-oxidanyl-propanedioic acid

Systemtic Name: 2-[2-[2-(4-acetyloxyphenyl)-4-oxidanylidene-1,3-thiazolidin-3-yl]ethyl]-2-oxidanyl-propanedioic acid Openeye Name: 2-[2-[2-(4-acetoxyphenyl)-4-oxo-thiazolidin-3-yl]ethyl]-2-hydroxy-propanedioic acid CAS Name: 2-[2-[2-(4-acetyloxyphenyl)-4-oxo-3-thiazolidinyl]ethyl]-2-hydroxypropanedioic acid IUPAC Name: 2-[2-[2-(4-acetyloxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]ethyl]-2-hydroxypropanedioic acid Traditional Name: 2-[2-[2-(4-acetoxyphenyl)-4-keto-thiazolidin-3-yl]ethyl]-2-hydroxy-malonic acid Formula: C16H17NO8S MolecularWeight: 383.37308

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)C2N(C(=O)CS2)CCC(C(=O)O)(C(=O)O)O

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)C2N(C(=O)CS2)CCC(C(=O)O)(C(=O)O)O

InChI

InChI=1S/C16H17NO8S/c1-9(18)25-11-4-2-10(3-5-11)13-17(12(19)8-26-13)7-6-16(24,14(20)21)15(22)23/h2-5,13,24H,6-8H2,1H3,(H,20,21)(H,22,23)