ethyl 4-cyano-2-methyl-3-phenyl-butanoate

Systemtic Name: ethyl 4-cyano-2-methyl-3-phenyl-butanoate Openeye Name: ethyl 4-cyano-2-methyl-3-phenyl-butanoate CAS Name: 4-cyano-2-methyl-3-phenylbutanoic acid ethyl ester IUPAC Name: ethyl 4-cyano-2-methyl-3-phenylbutanoate Traditional Name: 4-cyano-2-methyl-3-phenyl-butyric acid ethyl ester Formula: C14H17NO2 MolecularWeight: 231.29028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO2/c1-3-17-14(16)11(2)13(9-10-15)12-7-5-4-6-8-12/h4-8,11,13H,3,9H2,1-2H3