[(2S)-1-[(1S)-1-methyl-2-oxidanylidene-cyclohexyl]but-3-en-2-yl] ethanoate

Systemtic Name: [(2S)-1-[(1S)-1-methyl-2-oxidanylidene-cyclohexyl]but-3-en-2-yl] ethanoate Openeye Name: [(1S)-1-[[(1S)-1-methyl-2-oxo-cyclohexyl]methyl]allyl] acetate CAS Name: acetic acid [(2S)-1-[(1S)-1-methyl-2-oxocyclohexyl]but-3-en-2-yl] ester IUPAC Name: [(2S)-1-[(1S)-1-methyl-2-oxocyclohexyl]but-3-en-2-yl] acetate Traditional Name: acetic acid [(1S)-1-[[(1S)-2-keto-1-methyl-cyclohexyl]methyl]allyl] ester Formula: C13H20O3 MolecularWeight: 224.2961

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CC1(CCCCC1=O)C)C=C

Isomeric SMILES

CC(=O)O[C@@H](C[C@@]1(CCCCC1=O)C)C=C

InChI

InChI=1S/C13H20O3/c1-4-11(16-10(2)14)9-13(3)8-6-5-7-12(13)15/h4,11H,1,5-9H2,2-3H3/t11-,13+/m1/s1