methyl 2-cyano-2-methyl-decanoate

Systemtic Name: methyl 2-cyano-2-methyl-decanoate Openeye Name: methyl 2-cyano-2-methyl-decanoate CAS Name: 2-cyano-2-methyldecanoic acid methyl ester IUPAC Name: methyl 2-cyano-2-methyldecanoate Traditional Name: 2-cyano-2-methyl-capric acid methyl ester Formula: C13H23NO2 MolecularWeight: 225.32722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H23NO2/c1-4-5-6-7-8-9-10-13(2,11-14)12(15)16-3/h4-10H2,1-3H3