3-[2-(3-cyanophenyl)-1,2-bis(oxidanyl)ethyl]benzenecarbonitrile

Systemtic Name: 3-[2-(3-cyanophenyl)-1,2-bis(oxidanyl)ethyl]benzenecarbonitrile Openeye Name: 3-[2-(3-cyanophenyl)-1,2-dihydroxy-ethyl]benzonitrile CAS Name: 3-[2-(3-cyanophenyl)-1,2-dihydroxyethyl]benzonitrile IUPAC Name: 3-[2-(3-cyanophenyl)-1,2-dihydroxyethyl]benzonitrile Traditional Name: 3-[2-(3-cyanophenyl)-1,2-dihydroxy-ethyl]benzonitrile Formula: C16H12N2O2 MolecularWeight: 264.27868

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12N2O2/c17-9-11-3-1-5-13(7-11)15(19)16(20)14-6-2-4-12(8-14)10-18/h1-8,15-16,19-20H