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

Systemtic Name: (E)-N-(5-chloranyl-2-morpholin-4-yl-phenyl)-2-cyano-3-(2,5-dimethylphenyl)prop-2-enamide Openeye Name: (E)-N-(5-chloro-2-morpholino-phenyl)-2-cyano-3-(2,5-dimethylphenyl)prop-2-enamide CAS Name: (E)-N-[5-chloro-2-(4-morpholinyl)phenyl]-2-cyano-3-(2,5-dimethylphenyl)-2-propenamide IUPAC Name: (E)-N-(5-chloro-2-morpholin-4-ylphenyl)-2-cyano-3-(2,5-dimethylphenyl)prop-2-enamide Traditional Name: (E)-N-(5-chloro-2-morpholino-phenyl)-2-cyano-3-(2,5-dimethylphenyl)acrylamide Formula: C22H22ClN3O2 MolecularWeight: 395.88198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C=C(C#N)C(=O)NC2=C(C=CC(=C2)Cl)N3CCOCC3

Isomeric SMILES

CC1=CC(=C(C=C1)C)/C=C(\C#N)/C(=O)NC2=C(C=CC(=C2)Cl)N3CCOCC3

InChI

InChI=1S/C22H22ClN3O2/c1-15-3-4-16(2)17(11-15)12-18(14-24)22(27)25-20-13-19(23)5-6-21(20)26-7-9-28-10-8-26/h3-6,11-13H,7-10H2,1-2H3,(H,25,27)/b18-12+