2-[[4-[2-(2-chlorophenyl)-2-cyano-ethenyl]-2-ethoxy-6-iodanyl-phenoxy]methyl]benzenecarbonitrile

Systemtic Name: 2-[[4-[2-(2-chlorophenyl)-2-cyano-ethenyl]-2-ethoxy-6-iodanyl-phenoxy]methyl]benzenecarbonitrile Openeye Name: 2-[[4-[2-(2-chlorophenyl)-2-cyano-vinyl]-2-ethoxy-6-iodo-phenoxy]methyl]benzonitrile CAS Name: 2-[[4-[2-(2-chlorophenyl)-2-cyanoethenyl]-2-ethoxy-6-iodophenoxy]methyl]benzonitrile IUPAC Name: 2-[[4-[2-(2-chlorophenyl)-2-cyanoethenyl]-2-ethoxy-6-iodophenoxy]methyl]benzonitrile Traditional Name: 2-[[4-[2-(2-chlorophenyl)-2-cyano-vinyl]-2-ethoxy-6-iodo-phenoxy]methyl]benzonitrile Formula: C25H18ClIN2O2 MolecularWeight: 540.78009

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C(C#N)C2=CC=CC=C2Cl)I)OCC3=CC=CC=C3C#N

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=C(C#N)C2=CC=CC=C2Cl)I)OCC3=CC=CC=C3C#N

InChI

InChI=1S/C25H18ClIN2O2/c1-2-30-24-13-17(11-20(15-29)21-9-5-6-10-22(21)26)12-23(27)25(24)31-16-19-8-4-3-7-18(19)14-28/h3-13H,2,16H2,1H3