2-[2-nitro-4,5-bis(phenylmethoxy)phenyl]ethanenitrile

Systemtic Name: 2-[2-nitro-4,5-bis(phenylmethoxy)phenyl]ethanenitrile Openeye Name: 2-(4,5-dibenzyloxy-2-nitro-phenyl)acetonitrile CAS Name: 2-[2-nitro-4,5-bis(phenylmethoxy)phenyl]acetonitrile IUPAC Name: 2-[2-nitro-4,5-bis(phenylmethoxy)phenyl]acetonitrile Traditional Name: 2-(4,5-dibenzoxy-2-nitro-phenyl)acetonitrile Formula: C22H18N2O4 MolecularWeight: 374.38932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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