methyl 4-[bis[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexyl]methyl]benzoate

Systemtic Name: methyl 4-[bis[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexyl]methyl]benzoate Openeye Name: methyl 4-[bis(4,4-dimethyl-2,6-dioxo-cyclohexyl)methyl]benzoate CAS Name: 4-[bis(4,4-dimethyl-2,6-dioxocyclohexyl)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[bis(4,4-dimethyl-2,6-dioxocyclohexyl)methyl]benzoate Traditional Name: 4-[bis(2,6-diketo-4,4-dimethyl-cyclohexyl)methyl]benzoic acid methyl ester Formula: C25H30O6 MolecularWeight: 426.5021

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1)C(C2C(=O)CC(CC2=O)(C)C)C3=CC=C(C=C3)C(=O)OC)C

Isomeric SMILES

CC1(CC(=O)C(C(=O)C1)C(C2C(=O)CC(CC2=O)(C)C)C3=CC=C(C=C3)C(=O)OC)C

InChI

InChI=1S/C25H30O6/c1-24(2)10-16(26)21(17(27)11-24)20(14-6-8-15(9-7-14)23(30)31-5)22-18(28)12-25(3,4)13-19(22)29/h6-9,20-22H,10-13H2,1-5H3