2-[3,4-bis(phenylmethoxy)phenyl]-2-nitro-ethanenitrile

Systemtic Name: 2-[3,4-bis(phenylmethoxy)phenyl]-2-nitro-ethanenitrile Openeye Name: 2-(3,4-dibenzyloxyphenyl)-2-nitro-acetonitrile CAS Name: 2-[3,4-bis(phenylmethoxy)phenyl]-2-nitroacetonitrile IUPAC Name: 2-[3,4-bis(phenylmethoxy)phenyl]-2-nitroacetonitrile Traditional Name: 2-(3,4-dibenzoxyphenyl)-2-nitro-acetonitrile Formula: C22H18N2O4 MolecularWeight: 374.38932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C(C#N)[N+](=O)[O-])OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C(C#N)[N+](=O)[O-])OCC3=CC=CC=C3

InChI

InChI=1S/C22H18N2O4/c23-14-20(24(25)26)19-11-12-21(27-15-17-7-3-1-4-8-17)22(13-19)28-16-18-9-5-2-6-10-18/h1-13,20H,15-16H2