[4-acetyloxy-3-(3-cyano-3-oxidanyl-butyl)phenyl] ethanoate

Systemtic Name: [4-acetyloxy-3-(3-cyano-3-oxidanyl-butyl)phenyl] ethanoate Openeye Name: [4-acetoxy-3-(3-cyano-3-hydroxy-butyl)phenyl] acetate CAS Name: acetic acid [4-acetyloxy-3-(3-cyano-3-hydroxybutyl)phenyl] ester IUPAC Name: [4-acetyloxy-3-(3-cyano-3-hydroxybutyl)phenyl] acetate Traditional Name: acetic acid [4-acetoxy-3-(3-cyano-3-hydroxy-butyl)phenyl] ester Formula: C15H17NO5 MolecularWeight: 291.29918

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC(=C(C=C1)OC(=O)C)CCC(C)(C#N)O

Isomeric SMILES

CC(=O)OC1=CC(=C(C=C1)OC(=O)C)CCC(C)(C#N)O

InChI

InChI=1S/C15H17NO5/c1-10(17)20-13-4-5-14(21-11(2)18)12(8-13)6-7-15(3,19)9-16/h4-5,8,19H,6-7H2,1-3H3