(5-acetyloxy-2,5-dicyano-hexan-2-yl) ethanoate

Systemtic Name: (5-acetyloxy-2,5-dicyano-hexan-2-yl) ethanoate Openeye Name: (4-acetoxy-1,4-dicyano-1-methyl-pentyl) acetate CAS Name: acetic acid (5-acetyloxy-2,5-dicyanohexan-2-yl) ester IUPAC Name: (5-acetyloxy-2,5-dicyanohexan-2-yl) acetate Traditional Name: acetic acid (4-acetoxy-1,4-dicyano-1-methyl-pentyl) ester Formula: C12H16N2O4 MolecularWeight: 252.26644

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O4/c1-9(15)17-11(3,7-13)5-6-12(4,8-14)18-10(2)16/h5-6H2,1-4H3