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

Systemtic Name: (E)-3-(5-bromanyl-2-butoxy-phenyl)-2-cyano-N-(2,4-dimethylphenyl)prop-2-enamide Openeye Name: (E)-3-(5-bromo-2-butoxy-phenyl)-2-cyano-N-(2,4-dimethylphenyl)prop-2-enamide CAS Name: (E)-3-(5-bromo-2-butoxyphenyl)-2-cyano-N-(2,4-dimethylphenyl)-2-propenamide IUPAC Name: (E)-3-(5-bromo-2-butoxyphenyl)-2-cyano-N-(2,4-dimethylphenyl)prop-2-enamide Traditional Name: (E)-3-(5-bromo-2-butoxy-phenyl)-2-cyano-N-(2,4-dimethylphenyl)acrylamide Formula: C22H23BrN2O2 MolecularWeight: 427.33422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)Br)C=C(C#N)C(=O)NC2=C(C=C(C=C2)C)C

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)Br)/C=C(\C#N)/C(=O)NC2=C(C=C(C=C2)C)C

InChI

InChI=1S/C22H23BrN2O2/c1-4-5-10-27-21-9-7-19(23)13-17(21)12-18(14-24)22(26)25-20-8-6-15(2)11-16(20)3/h6-9,11-13H,4-5,10H2,1-3H3,(H,25,26)/b18-12+