2-[3-[(4-cyanophenyl)-oxidanyl-methyl]phenyl]propanedinitrile

Systemtic Name: 2-[3-[(4-cyanophenyl)-oxidanyl-methyl]phenyl]propanedinitrile Openeye Name: 2-[3-[(4-cyanophenyl)-hydroxy-methyl]phenyl]propanedinitrile CAS Name: 2-[3-[(4-cyanophenyl)-hydroxymethyl]phenyl]propanedinitrile IUPAC Name: 2-[3-[(4-cyanophenyl)-hydroxymethyl]phenyl]propanedinitrile Traditional Name: 2-[3-[(4-cyanophenyl)-hydroxy-methyl]phenyl]malononitrile Formula: C17H11N3O MolecularWeight: 273.28874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(C2=CC=C(C=C2)C#N)O)C(C#N)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C(C2=CC=C(C=C2)C#N)O)C(C#N)C#N

InChI

InChI=1S/C17H11N3O/c18-9-12-4-6-13(7-5-12)17(21)15-3-1-2-14(8-15)16(10-19)11-20/h1-8,16-17,21H