(E)-N-(5-chloranyl-2-morpholin-4-yl-phenyl)-2-cyano-3-(2,4-dimethoxyphenyl)prop-2-enamide

Systemtic Name: (E)-N-(5-chloranyl-2-morpholin-4-yl-phenyl)-2-cyano-3-(2,4-dimethoxyphenyl)prop-2-enamide Openeye Name: (E)-N-(5-chloro-2-morpholino-phenyl)-2-cyano-3-(2,4-dimethoxyphenyl)prop-2-enamide CAS Name: (E)-N-[5-chloro-2-(4-morpholinyl)phenyl]-2-cyano-3-(2,4-dimethoxyphenyl)-2-propenamide IUPAC Name: (E)-N-(5-chloro-2-morpholin-4-ylphenyl)-2-cyano-3-(2,4-dimethoxyphenyl)prop-2-enamide Traditional Name: (E)-N-(5-chloro-2-morpholino-phenyl)-2-cyano-3-(2,4-dimethoxyphenyl)acrylamide Formula: C22H22ClN3O4 MolecularWeight: 427.88078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C=C(C#N)C(=O)NC2=C(C=CC(=C2)Cl)N3CCOCC3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)/C=C(\C#N)/C(=O)NC2=C(C=CC(=C2)Cl)N3CCOCC3)OC

InChI

InChI=1S/C22H22ClN3O4/c1-28-18-5-3-15(21(13-18)29-2)11-16(14-24)22(27)25-19-12-17(23)4-6-20(19)26-7-9-30-10-8-26/h3-6,11-13H,7-10H2,1-2H3,(H,25,27)/b16-11+