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

Systemtic Name: (E)-N-(3-chloranyl-2-methyl-phenyl)-2-cyano-3-(4-morpholin-4-ylphenyl)prop-2-enamide Openeye Name: (E)-N-(3-chloro-2-methyl-phenyl)-2-cyano-3-(4-morpholinophenyl)prop-2-enamide CAS Name: (E)-N-(3-chloro-2-methylphenyl)-2-cyano-3-[4-(4-morpholinyl)phenyl]-2-propenamide IUPAC Name: (E)-N-(3-chloro-2-methylphenyl)-2-cyano-3-(4-morpholin-4-ylphenyl)prop-2-enamide Traditional Name: (E)-N-(3-chloro-2-methyl-phenyl)-2-cyano-3-(4-morpholinophenyl)acrylamide Formula: C21H20ClN3O2 MolecularWeight: 381.8554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20ClN3O2/c1-15-19(22)3-2-4-20(15)24-21(26)17(14-23)13-16-5-7-18(8-6-16)25-9-11-27-12-10-25/h2-8,13H,9-12H2,1H3,(H,24,26)/b17-13+