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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17BrN2O4/c1-12(24)13-4-7-15(8-5-13)22-18(25)3-2-10-23-19(26)16-9-6-14(21)11-17(16)20(23)27/h4-9,11H,2-3,10H2,1H3,(H,22,25)