(E)-2-cyano-3-(4-methoxy-3-oxidanyl-phenyl)-N-(4-morpholin-4-ylphenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(4-methoxy-3-oxidanyl-phenyl)-N-(4-morpholin-4-ylphenyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(3-hydroxy-4-methoxy-phenyl)-N-(4-morpholinophenyl)prop-2-enamide CAS Name: (E)-2-cyano-3-(3-hydroxy-4-methoxyphenyl)-N-[4-(4-morpholinyl)phenyl]-2-propenamide IUPAC Name: (E)-2-cyano-3-(3-hydroxy-4-methoxyphenyl)-N-(4-morpholin-4-ylphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-(3-hydroxy-4-methoxy-phenyl)-N-(4-morpholinophenyl)acrylamide Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O4/c1-27-20-7-2-15(13-19(20)25)12-16(14-22)21(26)23-17-3-5-18(6-4-17)24-8-10-28-11-9-24/h2-7,12-13,25H,8-11H2,1H3,(H,23,26)/b16-12+