ethyl 2-cyano-2-(3-methylbutyl)-5-oxidanylidene-hexanoate

Systemtic Name: ethyl 2-cyano-2-(3-methylbutyl)-5-oxidanylidene-hexanoate Openeye Name: ethyl 2-cyano-2-isopentyl-5-oxo-hexanoate CAS Name: 2-cyano-2-(3-methylbutyl)-5-oxohexanoic acid ethyl ester IUPAC Name: ethyl 2-cyano-2-(3-methylbutyl)-5-oxohexanoate Traditional Name: 2-cyano-2-isoamyl-5-keto-hexanoic acid ethyl ester Formula: C14H23NO3 MolecularWeight: 253.33732

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC(C)C)(CCC(=O)C)C#N

Isomeric SMILES

CCOC(=O)C(CCC(C)C)(CCC(=O)C)C#N

InChI

InChI=1S/C14H23NO3/c1-5-18-13(17)14(10-15,8-6-11(2)3)9-7-12(4)16/h11H,5-9H2,1-4H3