tert-butyl 5-cyano-2-ethanoyl-2-ethyl-pentanoate

Systemtic Name: tert-butyl 5-cyano-2-ethanoyl-2-ethyl-pentanoate Openeye Name: tert-butyl 2-acetyl-5-cyano-2-ethyl-pentanoate CAS Name: 2-acetyl-5-cyano-2-ethylpentanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-acetyl-5-cyano-2-ethylpentanoate Traditional Name: 2-acetyl-5-cyano-2-ethyl-valeric acid tert-butyl ester Formula: C14H23NO3 MolecularWeight: 253.33732

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H23NO3/c1-6-14(11(2)16,9-7-8-10-15)12(17)18-13(3,4)5/h6-9H2,1-5H3