4-[4-(4-ethanoyl-2-nitro-phenoxy)phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-(4-ethanoyl-2-nitro-phenoxy)phenyl]benzenecarbonitrile Openeye Name: 4-[4-(4-acetyl-2-nitro-phenoxy)phenyl]benzonitrile CAS Name: 4-[4-(4-acetyl-2-nitrophenoxy)phenyl]benzonitrile IUPAC Name: 4-[4-(4-acetyl-2-nitrophenoxy)phenyl]benzonitrile Traditional Name: 4-[4-(4-acetyl-2-nitro-phenoxy)phenyl]benzonitrile Formula: C21H14N2O4 MolecularWeight: 358.34686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)[N+](=O)[O-]

InChI

InChI=1S/C21H14N2O4/c1-14(24)18-8-11-21(20(12-18)23(25)26)27-19-9-6-17(7-10-19)16-4-2-15(13-22)3-5-16/h2-12H,1H3