3-[4-[(6-oxidanyl-6-oxidanylidene-hexyl)amino]phenyl]carbonyl-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 3-[4-[(6-oxidanyl-6-oxidanylidene-hexyl)amino]phenyl]carbonyl-1,3-thiazolidine-4-carboxylic acid Openeye Name: 3-[4-[(6-hydroxy-6-oxo-hexyl)amino]benzoyl]thiazolidine-4-carboxylic acid CAS Name: 3-[[4-[(6-hydroxy-6-oxohexyl)amino]phenyl]-oxomethyl]-4-thiazolidinecarboxylic acid IUPAC Name: 3-[4-[(6-hydroxy-6-oxohexyl)amino]benzoyl]-1,3-thiazolidine-4-carboxylic acid Traditional Name: 3-[4-[(6-hydroxy-6-keto-hexyl)amino]benzoyl]thiazolidine-4-carboxylic acid Formula: C17H22N2O5S MolecularWeight: 366.43198

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CS1)C(=O)C2=CC=C(C=C2)NCCCCCC(=O)O)C(=O)O

Isomeric SMILES

C1C(N(CS1)C(=O)C2=CC=C(C=C2)NCCCCCC(=O)O)C(=O)O

InChI

InChI=1S/C17H22N2O5S/c20-15(21)4-2-1-3-9-18-13-7-5-12(6-8-13)16(22)19-11-25-10-14(19)17(23)24/h5-8,14,18H,1-4,9-11H2,(H,20,21)(H,23,24)