ethyl 2-cyano-4,4-dimethyl-5-phenyl-pentanoate

Systemtic Name: ethyl 2-cyano-4,4-dimethyl-5-phenyl-pentanoate Openeye Name: ethyl 2-cyano-4,4-dimethyl-5-phenyl-pentanoate CAS Name: 2-cyano-4,4-dimethyl-5-phenylpentanoic acid ethyl ester IUPAC Name: ethyl 2-cyano-4,4-dimethyl-5-phenylpentanoate Traditional Name: 2-cyano-4,4-dimethyl-5-phenyl-valeric acid ethyl ester Formula: C16H21NO2 MolecularWeight: 259.34344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(C)(C)CC1=CC=CC=C1)C#N

Isomeric SMILES

CCOC(=O)C(CC(C)(C)CC1=CC=CC=C1)C#N

InChI

InChI=1S/C16H21NO2/c1-4-19-15(18)14(12-17)11-16(2,3)10-13-8-6-5-7-9-13/h5-9,14H,4,10-11H2,1-3H3