ethyl 2-cyano-3-(2,6-dimethyl-4-oxidanyl-phenyl)propanoate

Systemtic Name: ethyl 2-cyano-3-(2,6-dimethyl-4-oxidanyl-phenyl)propanoate Openeye Name: ethyl 2-cyano-3-(4-hydroxy-2,6-dimethyl-phenyl)propanoate CAS Name: 2-cyano-3-(4-hydroxy-2,6-dimethylphenyl)propanoic acid ethyl ester IUPAC Name: ethyl 2-cyano-3-(4-hydroxy-2,6-dimethylphenyl)propanoate Traditional Name: 2-cyano-3-(4-hydroxy-2,6-dimethyl-phenyl)propionic acid ethyl ester Formula: C14H17NO3 MolecularWeight: 247.28968

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=C(C=C(C=C1C)O)C)C#N

Isomeric SMILES

CCOC(=O)C(CC1=C(C=C(C=C1C)O)C)C#N

InChI

InChI=1S/C14H17NO3/c1-4-18-14(17)11(8-15)7-13-9(2)5-12(16)6-10(13)3/h5-6,11,16H,4,7H2,1-3H3