(E)-N-[1,3-bis(oxidanylidene)-2-phenyl-isoindol-5-yl]-3-(5-bromanyl-2-methoxy-phenyl)prop-2-enamide

Systemtic Name: (E)-N-[1,3-bis(oxidanylidene)-2-phenyl-isoindol-5-yl]-3-(5-bromanyl-2-methoxy-phenyl)prop-2-enamide Openeye Name: (E)-3-(5-bromo-2-methoxy-phenyl)-N-(1,3-dioxo-2-phenyl-isoindolin-5-yl)prop-2-enamide CAS Name: (E)-3-(5-bromo-2-methoxyphenyl)-N-(1,3-dioxo-2-phenyl-5-isoindolyl)-2-propenamide IUPAC Name: (E)-3-(5-bromo-2-methoxyphenyl)-N-(1,3-dioxo-2-phenylisoindol-5-yl)prop-2-enamide Traditional Name: (E)-3-(5-bromo-2-methoxy-phenyl)-N-(1,3-diketo-2-phenyl-isoindolin-5-yl)acrylamide Formula: C24H17BrN2O4 MolecularWeight: 477.30678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C=CC(=O)NC2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)Br)/C=C/C(=O)NC2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=CC=C4

InChI

InChI=1S/C24H17BrN2O4/c1-31-21-11-8-16(25)13-15(21)7-12-22(28)26-17-9-10-19-20(14-17)24(30)27(23(19)29)18-5-3-2-4-6-18/h2-14H,1H3,(H,26,28)/b12-7+