(E)-2-cyano-3-(3-ethoxy-4-prop-2-ynoxy-phenyl)-N-(4-morpholin-4-ylphenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(3-ethoxy-4-prop-2-ynoxy-phenyl)-N-(4-morpholin-4-ylphenyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(3-ethoxy-4-prop-2-ynoxy-phenyl)-N-(4-morpholinophenyl)prop-2-enamide CAS Name: (E)-2-cyano-3-(3-ethoxy-4-prop-2-ynoxyphenyl)-N-[4-(4-morpholinyl)phenyl]-2-propenamide IUPAC Name: (E)-2-cyano-3-(3-ethoxy-4-prop-2-ynoxyphenyl)-N-(4-morpholin-4-ylphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-(3-ethoxy-4-propargyloxy-phenyl)-N-(4-morpholinophenyl)acrylamide Formula: C25H25N3O4 MolecularWeight: 431.4837

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=CC=C(C=C2)N3CCOCC3)OCC#C

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)NC2=CC=C(C=C2)N3CCOCC3)OCC#C

InChI

InChI=1S/C25H25N3O4/c1-3-13-32-23-10-5-19(17-24(23)31-4-2)16-20(18-26)25(29)27-21-6-8-22(9-7-21)28-11-14-30-15-12-28/h1,5-10,16-17H,4,11-15H2,2H3,(H,27,29)/b20-16+