2-[[2-bromanyl-4-[(E)-2-cyano-2-(6-methoxy-1H-benzimidazol-2-yl)ethenyl]-6-methoxy-phenoxy]methyl]benzenecarbonitrile

Systemtic Name: 2-[[2-bromanyl-4-[(E)-2-cyano-2-(6-methoxy-1H-benzimidazol-2-yl)ethenyl]-6-methoxy-phenoxy]methyl]benzenecarbonitrile Openeye Name: 2-[[2-bromo-4-[(E)-2-cyano-2-(6-methoxy-1H-benzimidazol-2-yl)vinyl]-6-methoxy-phenoxy]methyl]benzonitrile CAS Name: 2-[[2-bromo-4-[(E)-2-cyano-2-(6-methoxy-1H-benzimidazol-2-yl)ethenyl]-6-methoxyphenoxy]methyl]benzonitrile IUPAC Name: 2-[[2-bromo-4-[(E)-2-cyano-2-(6-methoxy-1H-benzimidazol-2-yl)ethenyl]-6-methoxyphenoxy]methyl]benzonitrile Traditional Name: 2-[[2-bromo-4-[(E)-2-cyano-2-(6-methoxy-1H-benzimidazol-2-yl)vinyl]-6-methoxy-phenoxy]methyl]benzonitrile Formula: C26H19BrN4O3 MolecularWeight: 515.35806

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(N2)C(=CC3=CC(=C(C(=C3)Br)OCC4=CC=CC=C4C#N)OC)C#N

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(N2)/C(=C/C3=CC(=C(C(=C3)Br)OCC4=CC=CC=C4C#N)OC)/C#N

InChI

InChI=1S/C26H19BrN4O3/c1-32-20-7-8-22-23(12-20)31-26(30-22)19(14-29)9-16-10-21(27)25(24(11-16)33-2)34-15-18-6-4-3-5-17(18)13-28/h3-12H,15H2,1-2H3,(H,30,31)/b19-9+