[(Z)-2-cyano-1-ethoxy-6-methyl-1-oxidanyl-3-oxidanylidene-hept-1-en-4-yl] ethanoate

Systemtic Name: [(Z)-2-cyano-1-ethoxy-6-methyl-1-oxidanyl-3-oxidanylidene-hept-1-en-4-yl] ethanoate Openeye Name: [(Z)-3-cyano-4-ethoxy-4-hydroxy-1-isobutyl-2-oxo-but-3-enyl] acetate CAS Name: acetic acid [(Z)-2-cyano-1-ethoxy-1-hydroxy-6-methyl-3-oxohept-1-en-4-yl] ester IUPAC Name: [(Z)-2-cyano-1-ethoxy-1-hydroxy-6-methyl-3-oxohept-1-en-4-yl] acetate Traditional Name: acetic acid [(Z)-3-cyano-4-ethoxy-4-hydroxy-1-isobutyl-2-keto-but-3-enyl] ester Formula: C13H19NO5 MolecularWeight: 269.29366

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C#N)C(=O)C(CC(C)C)OC(=O)C)O

Isomeric SMILES

CCO/C(=C(/C#N)\C(=O)C(CC(C)C)OC(=O)C)/O

InChI

InChI=1S/C13H19NO5/c1-5-18-13(17)10(7-14)12(16)11(6-8(2)3)19-9(4)15/h8,11,17H,5-6H2,1-4H3/b13-10-