methyl 4-(4-cyano-3-oxidanyl-phenyl)butanoate

Systemtic Name: methyl 4-(4-cyano-3-oxidanyl-phenyl)butanoate Openeye Name: methyl 4-(4-cyano-3-hydroxy-phenyl)butanoate CAS Name: 4-(4-cyano-3-hydroxyphenyl)butanoic acid methyl ester IUPAC Name: methyl 4-(4-cyano-3-hydroxyphenyl)butanoate Traditional Name: 4-(4-cyano-3-hydroxy-phenyl)butyric acid methyl ester Formula: C12H13NO3 MolecularWeight: 219.23652

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC1=CC(=C(C=C1)C#N)O

Isomeric SMILES

COC(=O)CCCC1=CC(=C(C=C1)C#N)O

InChI

InChI=1S/C12H13NO3/c1-16-12(15)4-2-3-9-5-6-10(8-13)11(14)7-9/h5-7,14H,2-4H2,1H3