2-(1,3-benzodioxol-4-yl)-2-oxidanyl-ethanenitrile

Systemtic Name: 2-(1,3-benzodioxol-4-yl)-2-oxidanyl-ethanenitrile Openeye Name: 2-(1,3-benzodioxol-4-yl)-2-hydroxy-acetonitrile CAS Name: 2-(1,3-benzodioxol-4-yl)-2-hydroxyacetonitrile IUPAC Name: 2-(1,3-benzodioxol-4-yl)-2-hydroxyacetonitrile Traditional Name: 2-(1,3-benzodioxol-4-yl)-2-hydroxy-acetonitrile Formula: C9H7NO3 MolecularWeight: 177.15678

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=CC=CC(=C2O1)C(C#N)O

Isomeric SMILES

C1OC2=CC=CC(=C2O1)C(C#N)O

InChI

InChI=1S/C9H7NO3/c10-4-7(11)6-2-1-3-8-9(6)13-5-12-8/h1-3,7,11H,5H2