[(1R,2R)-2-methyl-3-oxidanylidene-2-(3-oxidanylidenebutyl)cyclohexyl] ethanoate

Systemtic Name: [(1R,2R)-2-methyl-3-oxidanylidene-2-(3-oxidanylidenebutyl)cyclohexyl] ethanoate Openeye Name: [(1R,2R)-2-methyl-3-oxo-2-(3-oxobutyl)cyclohexyl] acetate CAS Name: acetic acid [(1R,2R)-2-methyl-3-oxo-2-(3-oxobutyl)cyclohexyl] ester IUPAC Name: [(1R,2R)-2-methyl-3-oxo-2-(3-oxobutyl)cyclohexyl] acetate Traditional Name: acetic acid [(1R,2R)-3-keto-2-(3-ketobutyl)-2-methyl-cyclohexyl] ester Formula: C13H20O4 MolecularWeight: 240.2955

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1(C(CCCC1=O)OC(=O)C)C

Isomeric SMILES

CC(=O)CC[C@@]1([C@@H](CCCC1=O)OC(=O)C)C

InChI

InChI=1S/C13H20O4/c1-9(14)7-8-13(3)11(16)5-4-6-12(13)17-10(2)15/h12H,4-8H2,1-3H3/t12-,13+/m1/s1