5-[[(1S)-1-[(1S,3R)-3-carboxylatocyclopentyl]ethyl]sulfanylmethyl]furan-2-carboxylate

Systemtic Name: 5-[[(1S)-1-[(1S,3R)-3-carboxylatocyclopentyl]ethyl]sulfanylmethyl]furan-2-carboxylate Openeye Name: 5-[[(1S)-1-[(1S,3R)-3-carboxylatocyclopentyl]ethyl]sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[[(1S)-1-[(1S,3R)-3-carboxylatocyclopentyl]ethyl]thio]methyl]-2-furancarboxylate IUPAC Name: 5-[[(1S)-1-[(1S,3R)-3-carboxylatocyclopentyl]ethyl]sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[[(1S)-1-[(1S,3R)-3-carboxylatocyclopentyl]ethyl]thio]methyl]-2-furoate Formula: C14H16O5S-2 MolecularWeight: 296.33884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCC(C1)C(=O)[O-])SCC2=CC=C(O2)C(=O)[O-]

Isomeric SMILES

C[C@@H]([C@H]1CC[C@H](C1)C(=O)[O-])SCC2=CC=C(O2)C(=O)[O-]

InChI

InChI=1S/C14H18O5S/c1-8(9-2-3-10(6-9)13(15)16)20-7-11-4-5-12(19-11)14(17)18/h4-5,8-10H,2-3,6-7H2,1H3,(H,15,16)(H,17,18)/p-2/t8-,9-,10+/m0/s1