2-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]butanoic acid

Systemtic Name: 2-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]butanoic acid Openeye Name: 2-(5-bromo-1,3-dioxo-isoindolin-2-yl)butanoic acid CAS Name: 2-(5-bromo-1,3-dioxo-2-isoindolyl)butanoic acid IUPAC Name: 2-(5-bromo-1,3-dioxoisoindol-2-yl)butanoic acid Traditional Name: 2-(5-bromo-1,3-diketo-isoindolin-2-yl)butyric acid Formula: C12H10BrNO4 MolecularWeight: 312.1161

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)N1C(=O)C2=C(C1=O)C=C(C=C2)Br

Isomeric SMILES

CCC(C(=O)O)N1C(=O)C2=C(C1=O)C=C(C=C2)Br

InChI

InChI=1S/C12H10BrNO4/c1-2-9(12(17)18)14-10(15)7-4-3-6(13)5-8(7)11(14)16/h3-5,9H,2H2,1H3,(H,17,18)