2-(4-methylphenyl)-3-(6-oxidanyl-6-oxidanylidene-hexanoyl)-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 2-(4-methylphenyl)-3-(6-oxidanyl-6-oxidanylidene-hexanoyl)-1,3-thiazolidine-4-carboxylic acid Openeye Name: 3-(6-hydroxy-6-oxo-hexanoyl)-2-(p-tolyl)thiazolidine-4-carboxylic acid CAS Name: 3-(6-hydroxy-1,6-dioxohexyl)-2-(4-methylphenyl)-4-thiazolidinecarboxylic acid IUPAC Name: 3-(6-hydroxy-6-oxohexanoyl)-2-(4-methylphenyl)-1,3-thiazolidine-4-carboxylic acid Traditional Name: 3-(6-hydroxy-6-keto-hexanoyl)-2-(p-tolyl)thiazolidine-4-carboxylic acid Formula: C17H21NO5S MolecularWeight: 351.41734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2N(C(CS2)C(=O)O)C(=O)CCCCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2N(C(CS2)C(=O)O)C(=O)CCCCC(=O)O

InChI

InChI=1S/C17H21NO5S/c1-11-6-8-12(9-7-11)16-18(13(10-24-16)17(22)23)14(19)4-2-3-5-15(20)21/h6-9,13,16H,2-5,10H2,1H3,(H,20,21)(H,22,23)