2-(7-chloranyl-1,3-benzodioxol-5-yl)-2-oxidanyl-ethanenitrile

Systemtic Name: 2-(7-chloranyl-1,3-benzodioxol-5-yl)-2-oxidanyl-ethanenitrile Openeye Name: 2-(7-chloro-1,3-benzodioxol-5-yl)-2-hydroxy-acetonitrile CAS Name: 2-(7-chloro-1,3-benzodioxol-5-yl)-2-hydroxyacetonitrile IUPAC Name: 2-(7-chloro-1,3-benzodioxol-5-yl)-2-hydroxyacetonitrile Traditional Name: 2-(7-chloro-1,3-benzodioxol-5-yl)-2-hydroxy-acetonitrile Formula: C9H6ClNO3 MolecularWeight: 211.60184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H6ClNO3/c10-6-1-5(7(12)3-11)2-8-9(6)14-4-13-8/h1-2,7,12H,4H2