(E)-3-[5-bromanyl-2-[(E)-3-phenylprop-2-enoxy]phenyl]-2-cyano-N-(phenylmethyl)prop-2-enamide

Systemtic Name: (E)-3-[5-bromanyl-2-[(E)-3-phenylprop-2-enoxy]phenyl]-2-cyano-N-(phenylmethyl)prop-2-enamide Openeye Name: (E)-N-benzyl-3-[5-bromo-2-[(E)-cinnamyl]oxy-phenyl]-2-cyano-prop-2-enamide CAS Name: (E)-3-[5-bromo-2-[(E)-3-phenylprop-2-enoxy]phenyl]-2-cyano-N-(phenylmethyl)-2-propenamide IUPAC Name: (E)-N-benzyl-3-[5-bromo-2-[(E)-3-phenylprop-2-enoxy]phenyl]-2-cyanoprop-2-enamide Traditional Name: (E)-N-benzyl-3-[5-bromo-2-[(E)-cinnamyl]oxy-phenyl]-2-cyano-acrylamide Formula: C26H21BrN2O2 MolecularWeight: 473.36114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C(=CC2=C(C=CC(=C2)Br)OCC=CC3=CC=CC=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)/C(=C/C2=C(C=CC(=C2)Br)OC/C=C/C3=CC=CC=C3)/C#N

InChI

InChI=1S/C26H21BrN2O2/c27-24-13-14-25(31-15-7-12-20-8-3-1-4-9-20)22(17-24)16-23(18-28)26(30)29-19-21-10-5-2-6-11-21/h1-14,16-17H,15,19H2,(H,29,30)/b12-7+,23-16+