4-[(E)-2-[3-chloranyl-4-[(2-cyanophenyl)methoxy]-5-ethoxy-phenyl]-1-cyano-ethenyl]benzoate

Systemtic Name: 4-[(E)-2-[3-chloranyl-4-[(2-cyanophenyl)methoxy]-5-ethoxy-phenyl]-1-cyano-ethenyl]benzoate Openeye Name: 4-[(E)-2-[3-chloro-4-[(2-cyanophenyl)methoxy]-5-ethoxy-phenyl]-1-cyano-vinyl]benzoate CAS Name: 4-[(E)-2-[3-chloro-4-[(2-cyanophenyl)methoxy]-5-ethoxyphenyl]-1-cyanoethenyl]benzoate IUPAC Name: 4-[(E)-2-[3-chloro-4-[(2-cyanophenyl)methoxy]-5-ethoxyphenyl]-1-cyanoethenyl]benzoate Traditional Name: 4-[(E)-2-[3-chloro-4-(2-cyanobenzyl)oxy-5-ethoxy-phenyl]-1-cyano-vinyl]benzoate Formula: C26H18ClN2O4- MolecularWeight: 457.88512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C(C#N)C2=CC=C(C=C2)C(=O)[O-])Cl)OCC3=CC=CC=C3C#N

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C(/C#N)\C2=CC=C(C=C2)C(=O)[O-])Cl)OCC3=CC=CC=C3C#N

InChI

InChI=1S/C26H19ClN2O4/c1-2-32-24-13-17(11-22(15-29)18-7-9-19(10-8-18)26(30)31)12-23(27)25(24)33-16-21-6-4-3-5-20(21)14-28/h3-13H,2,16H2,1H3,(H,30,31)/p-1/b22-11-