methyl 2,2-dimethyl-4,6-bis(oxidanylidene)-5-(phenylcarbonyl)cyclohexane-1-carboxylate

Systemtic Name: methyl 2,2-dimethyl-4,6-bis(oxidanylidene)-5-(phenylcarbonyl)cyclohexane-1-carboxylate Openeye Name: methyl 5-benzoyl-2,2-dimethyl-4,6-dioxo-cyclohexanecarboxylate CAS Name: 5-benzoyl-2,2-dimethyl-4,6-dioxo-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 5-benzoyl-2,2-dimethyl-4,6-dioxocyclohexane-1-carboxylate Traditional Name: 5-benzoyl-4,6-diketo-2,2-dimethyl-cyclohexanecarboxylic acid methyl ester Formula: C17H18O5 MolecularWeight: 302.32182

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1C(=O)OC)C(=O)C2=CC=CC=C2)C

Isomeric SMILES

CC1(CC(=O)C(C(=O)C1C(=O)OC)C(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C17H18O5/c1-17(2)9-11(18)12(15(20)13(17)16(21)22-3)14(19)10-7-5-4-6-8-10/h4-8,12-13H,9H2,1-3H3