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2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]butanoic acid

2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]butanoic acid

Systemtic Name:2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]butanoic acid
Openeye Name:2-(4-nitro-1,3-dioxo-isoindolin-2-yl)butanoic acid
CAS Name:2-(4-nitro-1,3-dioxo-2-isoindolyl)butanoic acid
IUPAC Name:2-(4-nitro-1,3-dioxoisoindol-2-yl)butanoic acid
Traditional Name:2-(1,3-diketo-4-nitro-isoindolin-2-yl)butyric acid
Formula: C12H10N2O6
MolecularWeight: 278.2176
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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)N1C(=O)C2=C(C1=O)C(=CC=C2)[N+](=O)[O-]


Isomeric SMILES

CCC(C(=O)O)N1C(=O)C2=C(C1=O)C(=CC=C2)[N+](=O)[O-]


InChI

InChI=1S/C12H10N2O6/c1-2-7(12(17)18)13-10(15)6-4-3-5-8(14(19)20)9(6)11(13)16/h3-5,7H,2H2,1H3,(H,17,18)


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