2-methylsulfanylcyclohexane-1,3-dione

Systemtic Name: 2-methylsulfanylcyclohexane-1,3-dione Openeye Name: 2-methylsulfanylcyclohexane-1,3-dione CAS Name: 2-(methylthio)cyclohexane-1,3-dione IUPAC Name: 2-methylsulfanylcyclohexane-1,3-dione Traditional Name: 2-(methylthio)cyclohexane-1,3-quinone Formula: C7H10O2S MolecularWeight: 158.2181

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Descriptors Computed from Structure

Canonical SMILES:

CSC1C(=O)CCCC1=O

Isomeric SMILES

CSC1C(=O)CCCC1=O

InChI

InChI=1S/C7H10O2S/c1-10-7-5(8)3-2-4-6(7)9/h7H,2-4H2,1H3