[3-acetyloxy-5-[(R)-cyano(oxidanyl)methyl]phenyl] ethanoate

Systemtic Name: [3-acetyloxy-5-[(R)-cyano(oxidanyl)methyl]phenyl] ethanoate Openeye Name: [3-acetoxy-5-[(R)-cyano(hydroxy)methyl]phenyl] acetate CAS Name: acetic acid [3-acetyloxy-5-[(R)-cyano(hydroxy)methyl]phenyl] ester IUPAC Name: [3-acetyloxy-5-[(R)-cyano(hydroxy)methyl]phenyl] acetate Traditional Name: acetic acid [3-acetoxy-5-[(R)-cyano(hydroxy)methyl]phenyl] ester Formula: C12H11NO5 MolecularWeight: 249.21944

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=O)OC1=CC(=CC(=C1)[C@H](C#N)O)OC(=O)C

InChI

InChI=1S/C12H11NO5/c1-7(14)17-10-3-9(12(16)6-13)4-11(5-10)18-8(2)15/h3-5,12,16H,1-2H3/t12-/m0/s1