5,5-dimethyl-4-octylsulfanyl-furan-2-one

Systemtic Name: 5,5-dimethyl-4-octylsulfanyl-furan-2-one Openeye Name: 5,5-dimethyl-4-octylsulfanyl-furan-2-one CAS Name: 5,5-dimethyl-4-(octylthio)-2-furanone IUPAC Name: 5,5-dimethyl-4-octylsulfanylfuran-2-one Traditional Name: 5,5-dimethyl-4-(octylthio)furan-2-one Formula: C14H24O2S MolecularWeight: 256.40416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC1=CC(=O)OC1(C)C

Isomeric SMILES

CCCCCCCCSC1=CC(=O)OC1(C)C

InChI

InChI=1S/C14H24O2S/c1-4-5-6-7-8-9-10-17-12-11-13(15)16-14(12,2)3/h11H,4-10H2,1-3H3