2-oxidanyl-2-[2-[4-oxidanylidene-2-(3,4,5-trimethoxyphenyl)-1,3-thiazolidin-3-yl]ethyl]propanedioic acid

Systemtic Name: 2-oxidanyl-2-[2-[4-oxidanylidene-2-(3,4,5-trimethoxyphenyl)-1,3-thiazolidin-3-yl]ethyl]propanedioic acid Openeye Name: 2-hydroxy-2-[2-[4-oxo-2-(3,4,5-trimethoxyphenyl)thiazolidin-3-yl]ethyl]propanedioic acid CAS Name: 2-hydroxy-2-[2-[4-oxo-2-(3,4,5-trimethoxyphenyl)-3-thiazolidinyl]ethyl]propanedioic acid IUPAC Name: 2-hydroxy-2-[2-[4-oxo-2-(3,4,5-trimethoxyphenyl)-1,3-thiazolidin-3-yl]ethyl]propanedioic acid Traditional Name: 2-hydroxy-2-[2-[4-keto-2-(3,4,5-trimethoxyphenyl)thiazolidin-3-yl]ethyl]malonic acid Formula: C17H21NO9S MolecularWeight: 415.41494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2N(C(=O)CS2)CCC(C(=O)O)(C(=O)O)O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2N(C(=O)CS2)CCC(C(=O)O)(C(=O)O)O

InChI

InChI=1S/C17H21NO9S/c1-25-10-6-9(7-11(26-2)13(10)27-3)14-18(12(19)8-28-14)5-4-17(24,15(20)21)16(22)23/h6-7,14,24H,4-5,8H2,1-3H3,(H,20,21)(H,22,23)