2-(4-oxidanidyl-4-oxidanylidene-butyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: 2-(4-oxidanidyl-4-oxidanylidene-butyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: 2-(4-oxido-4-oxo-butyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(4-oxido-4-oxobutyl)-1,3-dioxo-5-isoindolecarboxylate IUPAC Name: 2-(4-oxido-4-oxobutyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 1,3-diketo-2-(4-keto-4-oxido-butyl)isoindoline-5-carboxylate Formula: C13H9NO6-2 MolecularWeight: 275.21366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)[O-])C(=O)N(C2=O)CCCC(=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1C(=O)[O-])C(=O)N(C2=O)CCCC(=O)[O-]

InChI

InChI=1S/C13H11NO6/c15-10(16)2-1-5-14-11(17)8-4-3-7(13(19)20)6-9(8)12(14)18/h3-4,6H,1-2,5H2,(H,15,16)(H,19,20)/p-2