methyl 5-cyano-2,4-dimethyl-pentanoate

Systemtic Name: methyl 5-cyano-2,4-dimethyl-pentanoate Openeye Name: methyl 5-cyano-2,4-dimethyl-pentanoate CAS Name: 5-cyano-2,4-dimethylpentanoic acid methyl ester IUPAC Name: methyl 5-cyano-2,4-dimethylpentanoate Traditional Name: 5-cyano-2,4-dimethyl-valeric acid methyl ester Formula: C9H15NO2 MolecularWeight: 169.2209

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H15NO2/c1-7(4-5-10)6-8(2)9(11)12-3/h7-8H,4,6H2,1-3H3