2-(4-methylcyclohexyl)sulfanylcyclohexane-1,4-dione

Systemtic Name: 2-(4-methylcyclohexyl)sulfanylcyclohexane-1,4-dione Openeye Name: 2-(4-methylcyclohexyl)sulfanylcyclohexane-1,4-dione CAS Name: 2-[(4-methylcyclohexyl)thio]cyclohexane-1,4-dione IUPAC Name: 2-(4-methylcyclohexyl)sulfanylcyclohexane-1,4-dione Traditional Name: 2-[(4-methylcyclohexyl)thio]cyclohexane-1,4-quinone Formula: C13H20O2S MolecularWeight: 240.3617

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)SC2CC(=O)CCC2=O

Isomeric SMILES

CC1CCC(CC1)SC2CC(=O)CCC2=O

InChI

InChI=1S/C13H20O2S/c1-9-2-5-11(6-3-9)16-13-8-10(14)4-7-12(13)15/h9,11,13H,2-8H2,1H3