2-(4-carboxyphenyl)-3-(9-oxidanyl-9-oxidanylidene-nonanoyl)-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 2-(4-carboxyphenyl)-3-(9-oxidanyl-9-oxidanylidene-nonanoyl)-1,3-thiazolidine-4-carboxylic acid Openeye Name: 2-(4-carboxyphenyl)-3-(9-hydroxy-9-oxo-nonanoyl)thiazolidine-4-carboxylic acid CAS Name: 2-(4-carboxyphenyl)-3-(9-hydroxy-1,9-dioxononyl)-4-thiazolidinecarboxylic acid IUPAC Name: 2-(4-carboxyphenyl)-3-(9-hydroxy-9-oxononanoyl)-1,3-thiazolidine-4-carboxylic acid Traditional Name: 2-(4-carboxyphenyl)-3-(9-hydroxy-9-keto-nonanoyl)thiazolidine-4-carboxylic acid Formula: C20H25NO7S MolecularWeight: 423.48

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C(S1)C2=CC=C(C=C2)C(=O)O)C(=O)CCCCCCCC(=O)O)C(=O)O

Isomeric SMILES

C1C(N(C(S1)C2=CC=C(C=C2)C(=O)O)C(=O)CCCCCCCC(=O)O)C(=O)O

InChI

InChI=1S/C20H25NO7S/c22-16(6-4-2-1-3-5-7-17(23)24)21-15(20(27)28)12-29-18(21)13-8-10-14(11-9-13)19(25)26/h8-11,15,18H,1-7,12H2,(H,23,24)(H,25,26)(H,27,28)