ethyl 2-cyano-3,3-dimethyl-4-phenyl-butanoate

Systemtic Name: ethyl 2-cyano-3,3-dimethyl-4-phenyl-butanoate Openeye Name: ethyl 2-cyano-3,3-dimethyl-4-phenyl-butanoate CAS Name: 2-cyano-3,3-dimethyl-4-phenylbutanoic acid ethyl ester IUPAC Name: ethyl 2-cyano-3,3-dimethyl-4-phenylbutanoate Traditional Name: 2-cyano-3,3-dimethyl-4-phenyl-butyric acid ethyl ester Formula: C15H19NO2 MolecularWeight: 245.31686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO2/c1-4-18-14(17)13(11-16)15(2,3)10-12-8-6-5-7-9-12/h5-9,13H,4,10H2,1-3H3