4-oxidanyl-8-(5-oxidanylidenecyclopenten-1-yl)sulfanyl-nonanoic acid

Systemtic Name: 4-oxidanyl-8-(5-oxidanylidenecyclopenten-1-yl)sulfanyl-nonanoic acid Openeye Name: 4-hydroxy-8-(5-oxocyclopenten-1-yl)sulfanyl-nonanoic acid CAS Name: 4-hydroxy-8-[(5-oxo-1-cyclopentenyl)thio]nonanoic acid IUPAC Name: 4-hydroxy-8-(5-oxocyclopenten-1-yl)sulfanylnonanoic acid Traditional Name: 4-hydroxy-8-[(5-ketocyclopenten-1-yl)thio]pelargonic acid Formula: C14H22O4S MolecularWeight: 286.38708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC(CCC(=O)O)O)SC1=CCCC1=O

Isomeric SMILES

CC(CCCC(CCC(=O)O)O)SC1=CCCC1=O

InChI

InChI=1S/C14H22O4S/c1-10(19-13-7-3-6-12(13)16)4-2-5-11(15)8-9-14(17)18/h7,10-11,15H,2-6,8-9H2,1H3,(H,17,18)