(E)-3-(2-bromanyl-4,5-dimethoxy-phenyl)-2-cyano-N-phenethyl-prop-2-enamide

Systemtic Name: (E)-3-(2-bromanyl-4,5-dimethoxy-phenyl)-2-cyano-N-phenethyl-prop-2-enamide Openeye Name: (E)-3-(2-bromo-4,5-dimethoxy-phenyl)-2-cyano-N-phenethyl-prop-2-enamide CAS Name: (E)-3-(2-bromo-4,5-dimethoxyphenyl)-2-cyano-N-phenethyl-2-propenamide IUPAC Name: (E)-3-(2-bromo-4,5-dimethoxyphenyl)-2-cyano-N-phenethylprop-2-enamide Traditional Name: (E)-3-(2-bromo-4,5-dimethoxy-phenyl)-2-cyano-N-phenethyl-acrylamide Formula: C20H19BrN2O3 MolecularWeight: 415.28046

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=C(C#N)C(=O)NCCC2=CC=CC=C2)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)/C=C(\C#N)/C(=O)NCCC2=CC=CC=C2)Br)OC

InChI

InChI=1S/C20H19BrN2O3/c1-25-18-11-15(17(21)12-19(18)26-2)10-16(13-22)20(24)23-9-8-14-6-4-3-5-7-14/h3-7,10-12H,8-9H2,1-2H3,(H,23,24)/b16-10+