methyl 4-[1-chloranyl-4-methyl-2,6-bis(oxidanylidene)cyclohexyl]butanoate

Systemtic Name: methyl 4-[1-chloranyl-4-methyl-2,6-bis(oxidanylidene)cyclohexyl]butanoate Openeye Name: methyl 4-(1-chloro-4-methyl-2,6-dioxo-cyclohexyl)butanoate CAS Name: 4-(1-chloro-4-methyl-2,6-dioxocyclohexyl)butanoic acid methyl ester IUPAC Name: methyl 4-(1-chloro-4-methyl-2,6-dioxocyclohexyl)butanoate Traditional Name: 4-(1-chloro-2,6-diketo-4-methyl-cyclohexyl)butyric acid methyl ester Formula: C12H17ClO4 MolecularWeight: 260.71398

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C(C(=O)C1)(CCCC(=O)OC)Cl

Isomeric SMILES

CC1CC(=O)C(C(=O)C1)(CCCC(=O)OC)Cl

InChI

InChI=1S/C12H17ClO4/c1-8-6-9(14)12(13,10(15)7-8)5-3-4-11(16)17-2/h8H,3-7H2,1-2H3