2,3-dimethyl-5-octylsulfanyl-cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2,3-dimethyl-5-octylsulfanyl-cyclohexa-2,5-diene-1,4-dione Openeye Name: 2,3-dimethyl-5-octylsulfanyl-1,4-benzoquinone CAS Name: 2,3-dimethyl-5-(octylthio)cyclohexa-2,5-diene-1,4-dione IUPAC Name: 2,3-dimethyl-5-octylsulfanylcyclohexa-2,5-diene-1,4-dione Traditional Name: 2,3-dimethyl-5-(octylthio)-p-benzoquinone Formula: C16H24O2S MolecularWeight: 280.42556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC1=CC(=O)C(=C(C1=O)C)C

Isomeric SMILES

CCCCCCCCSC1=CC(=O)C(=C(C1=O)C)C

InChI

InChI=1S/C16H24O2S/c1-4-5-6-7-8-9-10-19-15-11-14(17)12(2)13(3)16(15)18/h11H,4-10H2,1-3H3