5-methoxy-2,2-dimethyl-pentanenitrile; 1-methoxypropan-2-one

Systemtic Name: 5-methoxy-2,2-dimethyl-pentanenitrile; 1-methoxypropan-2-one Openeye Name: 5-methoxy-2,2-dimethyl-pentanenitrile; 1-methoxypropan-2-one CAS Name: 5-methoxy-2,2-dimethylpentanenitrile; 1-methoxy-2-propanone IUPAC Name: 5-methoxy-2,2-dimethylpentanenitrile; 1-methoxypropan-2-one Traditional Name: 1-methoxyacetone; 5-methoxy-2,2-dimethyl-valeronitrile Formula: C12H23NO3 MolecularWeight: 229.31592

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC.CC(C)(CCCOC)C#N

Isomeric SMILES

CC(=O)COC.CC(C)(CCCOC)C#N

InChI

InChI=1S/C8H15NO.C4H8O2/c1-8(2,7-9)5-4-6-10-3;1-4(5)3-6-2/h4-6H2,1-3H3;3H2,1-2H3