5-[3,5-bis(oxidanylidene)-4-(1-oxidanylpropylidene)cyclohexyl]-2-methylsulfanyl-benzenesulfonyl chloride

Systemtic Name: 5-[3,5-bis(oxidanylidene)-4-(1-oxidanylpropylidene)cyclohexyl]-2-methylsulfanyl-benzenesulfonyl chloride Openeye Name: 5-[4-(1-hydroxypropylidene)-3,5-dioxo-cyclohexyl]-2-methylsulfanyl-benzenesulfonyl chloride CAS Name: 5-[4-(1-hydroxypropylidene)-3,5-dioxocyclohexyl]-2-(methylthio)benzenesulfonyl chloride IUPAC Name: 5-[4-(1-hydroxypropylidene)-3,5-dioxocyclohexyl]-2-methylsulfanylbenzenesulfonyl chloride Traditional Name: 5-[4-(1-hydroxypropylidene)-3,5-diketo-cyclohexyl]-2-(methylthio)benzenesulfonyl chloride Formula: C16H17ClO5S2 MolecularWeight: 388.88618

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C1C(=O)CC(CC1=O)C2=CC(=C(C=C2)SC)S(=O)(=O)Cl)O

Isomeric SMILES

CCC(=C1C(=O)CC(CC1=O)C2=CC(=C(C=C2)SC)S(=O)(=O)Cl)O

InChI

InChI=1S/C16H17ClO5S2/c1-3-11(18)16-12(19)6-10(7-13(16)20)9-4-5-14(23-2)15(8-9)24(17,21)22/h4-5,8,10,18H,3,6-7H2,1-2H3