(E)-2-cyano-3-[4-(3-methylbutoxy)phenyl]-N-(4-morpholin-4-ylphenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[4-(3-methylbutoxy)phenyl]-N-(4-morpholin-4-ylphenyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(4-isopentyloxyphenyl)-N-(4-morpholinophenyl)prop-2-enamide CAS Name: (E)-2-cyano-3-[4-(3-methylbutoxy)phenyl]-N-[4-(4-morpholinyl)phenyl]-2-propenamide IUPAC Name: (E)-2-cyano-3-[4-(3-methylbutoxy)phenyl]-N-(4-morpholin-4-ylphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-(4-isoamoxyphenyl)-N-(4-morpholinophenyl)acrylamide Formula: C25H29N3O3 MolecularWeight: 419.51606

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H29N3O3/c1-19(2)11-14-31-24-9-3-20(4-10-24)17-21(18-26)25(29)27-22-5-7-23(8-6-22)28-12-15-30-16-13-28/h3-10,17,19H,11-16H2,1-2H3,(H,27,29)/b21-17+