2-[4-[(E)-2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]-2-iodanyl-6-methoxy-phenoxy]-N-phenyl-ethanamide

Systemtic Name: 2-[4-[(E)-2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]-2-iodanyl-6-methoxy-phenoxy]-N-phenyl-ethanamide Openeye Name: 2-[4-[(E)-2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)vinyl]-2-iodo-6-methoxy-phenoxy]-N-phenyl-acetamide CAS Name: 2-[4-[(E)-2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]-2-iodo-6-methoxyphenoxy]-N-phenylacetamide IUPAC Name: 2-[4-[(E)-2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]-2-iodo-6-methoxyphenoxy]-N-phenylacetamide Traditional Name: 2-[4-[(E)-2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)vinyl]-2-iodo-6-methoxy-phenoxy]-N-phenyl-acetamide Formula: C26H21IN4O3 MolecularWeight: 564.37441

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)C(=CC3=CC(=C(C(=C3)I)OCC(=O)NC4=CC=CC=C4)OC)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)/C(=C/C3=CC(=C(C(=C3)I)OCC(=O)NC4=CC=CC=C4)OC)/C#N

InChI

InChI=1S/C26H21IN4O3/c1-16-8-9-21-22(10-16)31-26(30-21)18(14-28)11-17-12-20(27)25(23(13-17)33-2)34-15-24(32)29-19-6-4-3-5-7-19/h3-13H,15H2,1-2H3,(H,29,32)(H,30,31)/b18-11+