5-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]benzene-1,3-dicarboxylic acid Openeye Name: 5-(5-nitro-1,3-dioxo-isoindolin-2-yl)benzene-1,3-dicarboxylic acid CAS Name: 5-(5-nitro-1,3-dioxo-2-isoindolyl)benzene-1,3-dicarboxylic acid IUPAC Name: 5-(5-nitro-1,3-dioxoisoindol-2-yl)benzene-1,3-dicarboxylic acid Traditional Name: 5-(1,3-diketo-5-nitro-isoindolin-2-yl)isophthalic acid Formula: C16H8N2O8 MolecularWeight: 356.24332

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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(=CC(=C3)C(=O)O)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C16H8N2O8/c19-13-11-2-1-9(18(25)26)6-12(11)14(20)17(13)10-4-7(15(21)22)3-8(5-10)16(23)24/h1-6H,(H,21,22)(H,23,24)