dimethyl 2-[(1S,3S)-3-but-3-enyl-5-oxidanylidene-cyclohexyl]propanedioate

Systemtic Name: dimethyl 2-[(1S,3S)-3-but-3-enyl-5-oxidanylidene-cyclohexyl]propanedioate Openeye Name: dimethyl 2-[(1S,3S)-3-but-3-enyl-5-oxo-cyclohexyl]propanedioate CAS Name: 2-[(1S,3S)-3-but-3-enyl-5-oxocyclohexyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(1S,3S)-3-but-3-enyl-5-oxocyclohexyl]propanedioate Traditional Name: 2-[(1S,3S)-3-but-3-enyl-5-keto-cyclohexyl]malonic acid dimethyl ester Formula: C15H22O5 MolecularWeight: 282.33218

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1CC(CC(=O)C1)CCC=C)C(=O)OC

Isomeric SMILES

COC(=O)C([C@H]1C[C@@H](CC(=O)C1)CCC=C)C(=O)OC

InChI

InChI=1S/C15H22O5/c1-4-5-6-10-7-11(9-12(16)8-10)13(14(17)19-2)15(18)20-3/h4,10-11,13H,1,5-9H2,2-3H3/t10-,11-/m0/s1