3-(5-nitro-3-oxidanylidene-1H-isoindol-2-yl)propanoic acid

Systemtic Name: 3-(5-nitro-3-oxidanylidene-1H-isoindol-2-yl)propanoic acid Openeye Name: 3-(6-nitro-1-oxo-isoindolin-2-yl)propanoic acid CAS Name: 3-(5-nitro-3-oxo-1H-isoindol-2-yl)propanoic acid IUPAC Name: 3-(5-nitro-3-oxo-1H-isoindol-2-yl)propanoic acid Traditional Name: 3-(1-keto-6-nitro-isoindolin-2-yl)propionic acid Formula: C11H10N2O5 MolecularWeight: 250.2075

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N1CCC(=O)O

Isomeric SMILES

C1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N1CCC(=O)O

InChI

InChI=1S/C11H10N2O5/c14-10(15)3-4-12-6-7-1-2-8(13(17)18)5-9(7)11(12)16/h1-2,5H,3-4,6H2,(H,14,15)