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

Systemtic Name: 3-(5-bromanyl-2-prop-2-enoxy-phenyl)-2-cyano-N-(2,5-dimethylphenyl)prop-2-enamide Openeye Name: 3-(2-allyloxy-5-bromo-phenyl)-2-cyano-N-(2,5-dimethylphenyl)prop-2-enamide CAS Name: 3-(5-bromo-2-prop-2-enoxyphenyl)-2-cyano-N-(2,5-dimethylphenyl)-2-propenamide IUPAC Name: 3-(5-bromo-2-prop-2-enoxyphenyl)-2-cyano-N-(2,5-dimethylphenyl)prop-2-enamide Traditional Name: 3-(2-allyloxy-5-bromo-phenyl)-2-cyano-N-(2,5-dimethylphenyl)acrylamide Formula: C21H19BrN2O2 MolecularWeight: 411.29176

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19BrN2O2/c1-4-9-26-20-8-7-18(22)12-16(20)11-17(13-23)21(25)24-19-10-14(2)5-6-15(19)3/h4-8,10-12H,1,9H2,2-3H3,(H,24,25)