[(S)-1,3-benzodioxol-5-yl(cyano)methyl] ethanoate

Systemtic Name: [(S)-1,3-benzodioxol-5-yl(cyano)methyl] ethanoate Openeye Name: [(S)-1,3-benzodioxol-5-yl(cyano)methyl] acetate CAS Name: acetic acid [(S)-1,3-benzodioxol-5-yl(cyano)methyl] ester IUPAC Name: [(S)-1,3-benzodioxol-5-yl(cyano)methyl] acetate Traditional Name: acetic acid [(S)-1,3-benzodioxol-5-yl(cyano)methyl] ester Formula: C11H9NO4 MolecularWeight: 219.19346

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C#N)C1=CC2=C(C=C1)OCO2

Isomeric SMILES

CC(=O)O[C@H](C#N)C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C11H9NO4/c1-7(13)16-11(5-12)8-2-3-9-10(4-8)15-6-14-9/h2-4,11H,6H2,1H3/t11-/m1/s1