(E)-3-(5-bromanyl-2-butoxy-phenyl)-2-cyano-N-(2,4,6-trimethylphenyl)prop-2-enamide

Systemtic Name: (E)-3-(5-bromanyl-2-butoxy-phenyl)-2-cyano-N-(2,4,6-trimethylphenyl)prop-2-enamide Openeye Name: (E)-3-(5-bromo-2-butoxy-phenyl)-2-cyano-N-(2,4,6-trimethylphenyl)prop-2-enamide CAS Name: (E)-3-(5-bromo-2-butoxyphenyl)-2-cyano-N-(2,4,6-trimethylphenyl)-2-propenamide IUPAC Name: (E)-3-(5-bromo-2-butoxyphenyl)-2-cyano-N-(2,4,6-trimethylphenyl)prop-2-enamide Traditional Name: (E)-3-(5-bromo-2-butoxy-phenyl)-2-cyano-N-mesityl-acrylamide Formula: C23H25BrN2O2 MolecularWeight: 441.3608

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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=C2C)C)C

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)Br)/C=C(\C#N)/C(=O)NC2=C(C=C(C=C2C)C)C

InChI

InChI=1S/C23H25BrN2O2/c1-5-6-9-28-21-8-7-20(24)13-18(21)12-19(14-25)23(27)26-22-16(3)10-15(2)11-17(22)4/h7-8,10-13H,5-6,9H2,1-4H3,(H,26,27)/b19-12+