4-[1,3-bis(oxidanylidene)isoindol-4-yl]butaneperoxoic acid

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-4-yl]butaneperoxoic acid Openeye Name: 4-(1,3-dioxoisoindolin-4-yl)butaneperoxoic acid CAS Name: 4-(1,3-dioxo-4-isoindolyl)butaneperoxoic acid IUPAC Name: 4-(1,3-dioxoisoindol-4-yl)butaneperoxoic acid Traditional Name: 4-(1,3-diketoisoindolin-4-yl)peroxybutyric acid Formula: C12H11NO5 MolecularWeight: 249.21944

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)CCCC(=O)OO)C(=O)NC2=O

Isomeric SMILES

C1=CC2=C(C(=C1)CCCC(=O)OO)C(=O)NC2=O

InChI

InChI=1S/C12H11NO5/c14-9(18-17)6-2-4-7-3-1-5-8-10(7)12(16)13-11(8)15/h1,3,5,17H,2,4,6H2,(H,13,15,16)