4-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2-ethanoylphenyl)butanamide

Systemtic Name: 4-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2-ethanoylphenyl)butanamide Openeye Name: N-(2-acetylphenyl)-4-(5-bromo-1,3-dioxo-isoindolin-2-yl)butanamide CAS Name: N-(2-acetylphenyl)-4-(5-bromo-1,3-dioxo-2-isoindolyl)butanamide IUPAC Name: N-(2-acetylphenyl)-4-(5-bromo-1,3-dioxoisoindol-2-yl)butanamide Traditional Name: N-(2-acetylphenyl)-4-(5-bromo-1,3-diketo-isoindolin-2-yl)butyramide Formula: C20H17BrN2O4 MolecularWeight: 429.26398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=C1NC(=O)CCCN2C(=O)C3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

CC(=O)C1=CC=CC=C1NC(=O)CCCN2C(=O)C3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C20H17BrN2O4/c1-12(24)14-5-2-3-6-17(14)22-18(25)7-4-10-23-19(26)15-9-8-13(21)11-16(15)20(23)27/h2-3,5-6,8-9,11H,4,7,10H2,1H3,(H,22,25)