(E)-3-[5-bromanyl-2-(2-methylpropoxy)phenyl]-2-cyano-N-(1-phenylethyl)prop-2-enamide

Systemtic Name: (E)-3-[5-bromanyl-2-(2-methylpropoxy)phenyl]-2-cyano-N-(1-phenylethyl)prop-2-enamide Openeye Name: (E)-3-(5-bromo-2-isobutoxy-phenyl)-2-cyano-N-(1-phenylethyl)prop-2-enamide CAS Name: (E)-3-[5-bromo-2-(2-methylpropoxy)phenyl]-2-cyano-N-(1-phenylethyl)-2-propenamide IUPAC Name: (E)-3-[5-bromo-2-(2-methylpropoxy)phenyl]-2-cyano-N-(1-phenylethyl)prop-2-enamide Traditional Name: (E)-3-(5-bromo-2-isobutoxy-phenyl)-2-cyano-N-(1-phenylethyl)acrylamide Formula: C22H23BrN2O2 MolecularWeight: 427.33422

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23BrN2O2/c1-15(2)14-27-21-10-9-20(23)12-18(21)11-19(13-24)22(26)25-16(3)17-7-5-4-6-8-17/h4-12,15-16H,14H2,1-3H3,(H,25,26)/b19-11+