2-[3-(dimethoxymethyl)-4-nitro-phenyl]-2-phenyl-ethanenitrile

Systemtic Name: 2-[3-(dimethoxymethyl)-4-nitro-phenyl]-2-phenyl-ethanenitrile Openeye Name: 2-[3-(dimethoxymethyl)-4-nitro-phenyl]-2-phenyl-acetonitrile CAS Name: 2-[3-(dimethoxymethyl)-4-nitrophenyl]-2-phenylacetonitrile IUPAC Name: 2-[3-(dimethoxymethyl)-4-nitrophenyl]-2-phenylacetonitrile Traditional Name: 2-[3-(dimethoxymethyl)-4-nitro-phenyl]-2-phenyl-acetonitrile Formula: C17H16N2O4 MolecularWeight: 312.31994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(C1=C(C=CC(=C1)C(C#N)C2=CC=CC=C2)[N+](=O)[O-])OC

Isomeric SMILES

COC(C1=C(C=CC(=C1)C(C#N)C2=CC=CC=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C17H16N2O4/c1-22-17(23-2)14-10-13(8-9-16(14)19(20)21)15(11-18)12-6-4-3-5-7-12/h3-10,15,17H,1-2H3