2-heptylsulfanyl-4-oxidanyl-cyclopentan-1-one

Systemtic Name: 2-heptylsulfanyl-4-oxidanyl-cyclopentan-1-one Openeye Name: 2-heptylsulfanyl-4-hydroxy-cyclopentanone CAS Name: 2-(heptylthio)-4-hydroxy-1-cyclopentanone IUPAC Name: 2-heptylsulfanyl-4-hydroxycyclopentan-1-one Traditional Name: 2-(heptylthio)-4-hydroxy-cyclopentanone Formula: C12H22O2S MolecularWeight: 230.36688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCSC1CC(CC1=O)O

Isomeric SMILES

CCCCCCCSC1CC(CC1=O)O

InChI

InChI=1S/C12H22O2S/c1-2-3-4-5-6-7-15-12-9-10(13)8-11(12)14/h10,12-13H,2-9H2,1H3