(E)-3-[5-(2-bromanyl-4-nitro-phenyl)furan-2-yl]-2-cyano-N-(2-methylphenyl)prop-2-enamide

Systemtic Name: (E)-3-[5-(2-bromanyl-4-nitro-phenyl)furan-2-yl]-2-cyano-N-(2-methylphenyl)prop-2-enamide Openeye Name: (E)-3-[5-(2-bromo-4-nitro-phenyl)-2-furyl]-2-cyano-N-(o-tolyl)prop-2-enamide CAS Name: (E)-3-[5-(2-bromo-4-nitrophenyl)-2-furanyl]-2-cyano-N-(2-methylphenyl)-2-propenamide IUPAC Name: (E)-3-[5-(2-bromo-4-nitrophenyl)furan-2-yl]-2-cyano-N-(2-methylphenyl)prop-2-enamide Traditional Name: (E)-3-[5-(2-bromo-4-nitro-phenyl)-2-furyl]-2-cyano-N-(o-tolyl)acrylamide Formula: C21H14BrN3O4 MolecularWeight: 452.25756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(=CC2=CC=C(O2)C3=C(C=C(C=C3)[N+](=O)[O-])Br)C#N

Isomeric SMILES

CC1=CC=CC=C1NC(=O)/C(=C/C2=CC=C(O2)C3=C(C=C(C=C3)[N+](=O)[O-])Br)/C#N

InChI

InChI=1S/C21H14BrN3O4/c1-13-4-2-3-5-19(13)24-21(26)14(12-23)10-16-7-9-20(29-16)17-8-6-15(25(27)28)11-18(17)22/h2-11H,1H3,(H,24,26)/b14-10+