[(E)-3-methyl-4-oxidanylidene-but-2-enyl] ethanoate ethanoate

Systemtic Name: [(E)-3-methyl-4-oxidanylidene-but-2-enyl] ethanoate ethanoate Openeye Name: [(E)-3-methyl-4-oxo-but-2-enyl] acetate acetate CAS Name: acetic acid [(E)-3-methyl-4-oxobut-2-enyl] ester acetate IUPAC Name: [(E)-3-methyl-4-oxobut-2-enyl] acetate acetate Traditional Name: acetic acid [(E)-4-keto-3-methyl-but-2-enyl] ester acetate Formula: C9H13O5- MolecularWeight: 201.19652

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCOC(=O)C)C=O.CC(=O)[O-]

Isomeric SMILES

C/C(=C\COC(=O)C)/C=O.CC(=O)[O-]

InChI

InChI=1S/C7H10O3.C2H4O2/c1-6(5-8)3-4-10-7(2)9;1-2(3)4/h3,5H,4H2,1-2H3;1H3,(H,3,4)/p-1/b6-3+;