(E)-7-[4-oxidanylidene-2-(3-oxidanyloctyl)-1,3-thiazolidin-3-yl]hept-5-enoic acid

Systemtic Name: (E)-7-[4-oxidanylidene-2-(3-oxidanyloctyl)-1,3-thiazolidin-3-yl]hept-5-enoic acid Openeye Name: (E)-7-[2-(3-hydroxyoctyl)-4-oxo-thiazolidin-3-yl]hept-5-enoic acid CAS Name: (E)-7-[2-(3-hydroxyoctyl)-4-oxo-3-thiazolidinyl]-5-heptenoic acid IUPAC Name: (E)-7-[2-(3-hydroxyoctyl)-4-oxo-1,3-thiazolidin-3-yl]hept-5-enoic acid Traditional Name: (E)-7-[2-(3-hydroxyoctyl)-4-keto-thiazolidin-3-yl]hept-5-enoic acid Formula: C18H31NO4S MolecularWeight: 357.50804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCC1N(C(=O)CS1)CC=CCCCC(=O)O)O

Isomeric SMILES

CCCCCC(CCC1N(C(=O)CS1)C/C=C/CCCC(=O)O)O

InChI

InChI=1S/C18H31NO4S/c1-2-3-6-9-15(20)11-12-17-19(16(21)14-24-17)13-8-5-4-7-10-18(22)23/h5,8,15,17,20H,2-4,6-7,9-14H2,1H3,(H,22,23)/b8-5+