2-[(E)-2-methyl-2-oxidanyl-hept-4-enyl]sulfanylcyclopent-2-en-1-one

Systemtic Name: 2-[(E)-2-methyl-2-oxidanyl-hept-4-enyl]sulfanylcyclopent-2-en-1-one Openeye Name: 2-[(E)-2-hydroxy-2-methyl-hept-4-enyl]sulfanylcyclopent-2-en-1-one CAS Name: 2-[[(E)-2-hydroxy-2-methylhept-4-enyl]thio]-1-cyclopent-2-enone IUPAC Name: 2-[(E)-2-hydroxy-2-methylhept-4-enyl]sulfanylcyclopent-2-en-1-one Traditional Name: 2-[[(E)-2-hydroxy-2-methyl-hept-4-enyl]thio]cyclopent-2-en-1-one Formula: C13H20O2S MolecularWeight: 240.3617

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC=CCC(C)(CSC1=CCCC1=O)O

Isomeric SMILES

CC/C=C/CC(C)(CSC1=CCCC1=O)O

InChI

InChI=1S/C13H20O2S/c1-3-4-5-9-13(2,15)10-16-12-8-6-7-11(12)14/h4-5,8,15H,3,6-7,9-10H2,1-2H3/b5-4+