2-(1,3-benzodioxol-5-yl)ethanenitrile

Systemtic Name: 2-(1,3-benzodioxol-5-yl)ethanenitrile Openeye Name: 2-(1,3-benzodioxol-5-yl)acetonitrile CAS Name: 2-(1,3-benzodioxol-5-yl)acetonitrile IUPAC Name: 2-(1,3-benzodioxol-5-yl)acetonitrile Traditional Name: 2-(1,3-benzodioxol-5-yl)acetonitrile Formula: C9H7NO2 MolecularWeight: 161.15738

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CC#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CC#N

InChI

InChI=1S/C9H7NO2/c10-4-3-7-1-2-8-9(5-7)12-6-11-8/h1-2,5H,3,6H2