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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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