[(E)-1,1-dideuterio-3-methyl-6-oxidanylidene-hex-2-enyl] ethanoate

Systemtic Name: [(E)-1,1-dideuterio-3-methyl-6-oxidanylidene-hex-2-enyl] ethanoate Openeye Name: [(E)-1,1-dideuterio-3-methyl-6-oxo-hex-2-enyl] acetate CAS Name: acetic acid [(E)-1,1-dideuterio-3-methyl-6-oxohex-2-enyl] ester IUPAC Name: [(E)-1,1-dideuterio-3-methyl-6-oxohex-2-enyl] acetate Traditional Name: acetic acid [(E)-1,1-dideuterio-6-keto-3-methyl-hex-2-enyl] ester Formula: C9H14O3 MolecularWeight: 172.217984

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCOC(=O)C)CCC=O

Isomeric SMILES

[2H]C([2H])(/C=C(\C)/CCC=O)OC(=O)C

InChI

InChI=1S/C9H14O3/c1-8(4-3-6-10)5-7-12-9(2)11/h5-6H,3-4,7H2,1-2H3/b8-5+/i7D2