(E)-3-(4-bromophenyl)-N-[3-(2-pyridin-2-ylethynyl)phenyl]prop-2-enamide

Systemtic Name: (E)-3-(4-bromophenyl)-N-[3-(2-pyridin-2-ylethynyl)phenyl]prop-2-enamide Openeye Name: (E)-3-(4-bromophenyl)-N-[3-[2-(2-pyridyl)ethynyl]phenyl]prop-2-enamide CAS Name: (E)-3-(4-bromophenyl)-N-[3-[2-(2-pyridinyl)ethynyl]phenyl]-2-propenamide IUPAC Name: (E)-3-(4-bromophenyl)-N-[3-(2-pyridin-2-ylethynyl)phenyl]prop-2-enamide Traditional Name: (E)-3-(4-bromophenyl)-N-[3-[2-(2-pyridyl)ethynyl]phenyl]acrylamide Formula: C22H15BrN2O MolecularWeight: 403.2713

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C#CC2=CC(=CC=C2)NC(=O)C=CC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=NC(=C1)C#CC2=CC(=CC=C2)NC(=O)/C=C/C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H15BrN2O/c23-19-11-7-17(8-12-19)10-14-22(26)25-21-6-3-4-18(16-21)9-13-20-5-1-2-15-24-20/h1-8,10-12,14-16H,(H,25,26)/b14-10+