(E)-3-(3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)-2-cyano-N-(2,4-dimethylphenyl)prop-2-enamide

Systemtic Name: (E)-3-(3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)-2-cyano-N-(2,4-dimethylphenyl)prop-2-enamide Openeye Name: (E)-3-(4-allyloxy-3-bromo-5-methoxy-phenyl)-2-cyano-N-(2,4-dimethylphenyl)prop-2-enamide CAS Name: (E)-3-(3-bromo-5-methoxy-4-prop-2-enoxyphenyl)-2-cyano-N-(2,4-dimethylphenyl)-2-propenamide IUPAC Name: (E)-3-(3-bromo-5-methoxy-4-prop-2-enoxyphenyl)-2-cyano-N-(2,4-dimethylphenyl)prop-2-enamide Traditional Name: (E)-3-(4-allyloxy-3-bromo-5-methoxy-phenyl)-2-cyano-N-(2,4-dimethylphenyl)acrylamide Formula: C22H21BrN2O3 MolecularWeight: 441.31774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(=CC2=CC(=C(C(=C2)Br)OCC=C)OC)C#N)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)/C(=C/C2=CC(=C(C(=C2)Br)OCC=C)OC)/C#N)C

InChI

InChI=1S/C22H21BrN2O3/c1-5-8-28-21-18(23)11-16(12-20(21)27-4)10-17(13-24)22(26)25-19-7-6-14(2)9-15(19)3/h5-7,9-12H,1,8H2,2-4H3,(H,25,26)/b17-10+