[3-chloranyl-4-[4-methyl-2,6-bis(oxidanylidene)cyclohexyl]carbonyl-phenyl] methanesulfonate

Systemtic Name: [3-chloranyl-4-[4-methyl-2,6-bis(oxidanylidene)cyclohexyl]carbonyl-phenyl] methanesulfonate Openeye Name: [3-chloro-4-(4-methyl-2,6-dioxo-cyclohexanecarbonyl)phenyl] methanesulfonate CAS Name: methanesulfonic acid [3-chloro-4-[(4-methyl-2,6-dioxocyclohexyl)-oxomethyl]phenyl] ester IUPAC Name: [3-chloro-4-(4-methyl-2,6-dioxocyclohexanecarbonyl)phenyl] methanesulfonate Traditional Name: methanesulfonic acid [3-chloro-4-(2,6-diketo-4-methyl-cyclohexanecarbonyl)phenyl] ester Formula: C15H15ClO6S MolecularWeight: 358.794

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C(C(=O)C1)C(=O)C2=C(C=C(C=C2)OS(=O)(=O)C)Cl

Isomeric SMILES

CC1CC(=O)C(C(=O)C1)C(=O)C2=C(C=C(C=C2)OS(=O)(=O)C)Cl

InChI

InChI=1S/C15H15ClO6S/c1-8-5-12(17)14(13(18)6-8)15(19)10-4-3-9(7-11(10)16)22-23(2,20)21/h3-4,7-8,14H,5-6H2,1-2H3