(E)-2-cyano-3-(3,5-dimethoxy-4-oxidanyl-phenyl)-N-(4-morpholin-4-ylphenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(3,5-dimethoxy-4-oxidanyl-phenyl)-N-(4-morpholin-4-ylphenyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(4-hydroxy-3,5-dimethoxy-phenyl)-N-(4-morpholinophenyl)prop-2-enamide CAS Name: (E)-2-cyano-3-(4-hydroxy-3,5-dimethoxyphenyl)-N-[4-(4-morpholinyl)phenyl]-2-propenamide IUPAC Name: (E)-2-cyano-3-(4-hydroxy-3,5-dimethoxyphenyl)-N-(4-morpholin-4-ylphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-(4-hydroxy-3,5-dimethoxy-phenyl)-N-(4-morpholinophenyl)acrylamide Formula: C22H23N3O5 MolecularWeight: 409.43512

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)OC)C=C(C#N)C(=O)NC2=CC=C(C=C2)N3CCOCC3

Isomeric SMILES

COC1=CC(=CC(=C1O)OC)/C=C(\C#N)/C(=O)NC2=CC=C(C=C2)N3CCOCC3

InChI

InChI=1S/C22H23N3O5/c1-28-19-12-15(13-20(29-2)21(19)26)11-16(14-23)22(27)24-17-3-5-18(6-4-17)25-7-9-30-10-8-25/h3-6,11-13,26H,7-10H2,1-2H3,(H,24,27)/b16-11+