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

Systemtic Name: (E)-N-(3-chloranyl-2-methyl-phenyl)-2-cyano-3-(2-methoxy-4-morpholin-4-yl-phenyl)prop-2-enamide Openeye Name: (E)-N-(3-chloro-2-methyl-phenyl)-2-cyano-3-(2-methoxy-4-morpholino-phenyl)prop-2-enamide CAS Name: (E)-N-(3-chloro-2-methylphenyl)-2-cyano-3-[2-methoxy-4-(4-morpholinyl)phenyl]-2-propenamide IUPAC Name: (E)-N-(3-chloro-2-methylphenyl)-2-cyano-3-(2-methoxy-4-morpholin-4-ylphenyl)prop-2-enamide Traditional Name: (E)-N-(3-chloro-2-methyl-phenyl)-2-cyano-3-(2-methoxy-4-morpholino-phenyl)acrylamide Formula: C22H22ClN3O3 MolecularWeight: 411.88138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C(=CC2=C(C=C(C=C2)N3CCOCC3)OC)C#N

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)/C(=C/C2=C(C=C(C=C2)N3CCOCC3)OC)/C#N

InChI

InChI=1S/C22H22ClN3O3/c1-15-19(23)4-3-5-20(15)25-22(27)17(14-24)12-16-6-7-18(13-21(16)28-2)26-8-10-29-11-9-26/h3-7,12-13H,8-11H2,1-2H3,(H,25,27)/b17-12+