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

Systemtic Name: 2-nitro-4-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]benzoic acid Openeye Name: 2-nitro-4-(4-nitro-1,3-dioxo-isoindolin-2-yl)benzoic acid CAS Name: 2-nitro-4-(4-nitro-1,3-dioxo-2-isoindolyl)benzoic acid IUPAC Name: 2-nitro-4-(4-nitro-1,3-dioxoisoindol-2-yl)benzoic acid Traditional Name: 4-(1,3-diketo-4-nitro-isoindolin-2-yl)-2-nitro-benzoic acid Formula: C15H7N3O8 MolecularWeight: 357.23138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)N(C2=O)C3=CC(=C(C=C3)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)N(C2=O)C3=CC(=C(C=C3)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C15H7N3O8/c19-13-9-2-1-3-10(17(23)24)12(9)14(20)16(13)7-4-5-8(15(21)22)11(6-7)18(25)26/h1-6H,(H,21,22)