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

Systemtic Name: (E)-N-(5-chloranyl-2-morpholin-4-yl-phenyl)-2-cyano-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enamide Openeye Name: (E)-N-(5-chloro-2-morpholino-phenyl)-2-cyano-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enamide CAS Name: (E)-N-[5-chloro-2-(4-morpholinyl)phenyl]-2-cyano-3-(4-hydroxy-3-methoxyphenyl)-2-propenamide IUPAC Name: (E)-N-(5-chloro-2-morpholin-4-ylphenyl)-2-cyano-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide Traditional Name: (E)-N-(5-chloro-2-morpholino-phenyl)-2-cyano-3-(4-hydroxy-3-methoxy-phenyl)acrylamide Formula: C21H20ClN3O4 MolecularWeight: 413.8542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20ClN3O4/c1-28-20-11-14(2-5-19(20)26)10-15(13-23)21(27)24-17-12-16(22)3-4-18(17)25-6-8-29-9-7-25/h2-5,10-12,26H,6-9H2,1H3,(H,24,27)/b15-10+