2-[1H-indol-3-yl(oxidanyl)methyl]propanedinitrile

Systemtic Name: 2-[1H-indol-3-yl(oxidanyl)methyl]propanedinitrile Openeye Name: 2-[hydroxy(1H-indol-3-yl)methyl]propanedinitrile CAS Name: 2-[hydroxy(1H-indol-3-yl)methyl]propanedinitrile IUPAC Name: 2-[hydroxy(1H-indol-3-yl)methyl]propanedinitrile Traditional Name: 2-[hydroxy(1H-indol-3-yl)methyl]malononitrile Formula: C12H9N3O MolecularWeight: 211.21936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)C(C(C#N)C#N)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C(C(C#N)C#N)O

InChI

InChI=1S/C12H9N3O/c13-5-8(6-14)12(16)10-7-15-11-4-2-1-3-9(10)11/h1-4,7-8,12,15-16H