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

Systemtic Name: 5-[5-(3-nitrophenoxy)-1,3-bis(oxidanylidene)isoindol-2-yl]benzene-1,3-dicarboxylic acid Openeye Name: 5-[5-(3-nitrophenoxy)-1,3-dioxo-isoindolin-2-yl]benzene-1,3-dicarboxylic acid CAS Name: 5-[5-(3-nitrophenoxy)-1,3-dioxo-2-isoindolyl]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[5-(3-nitrophenoxy)-1,3-dioxoisoindol-2-yl]benzene-1,3-dicarboxylic acid Traditional Name: 5-[1,3-diketo-5-(3-nitrophenoxy)isoindolin-2-yl]isophthalic acid Formula: C22H12N2O9 MolecularWeight: 448.33868

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC(=CC(=C4)C(=O)O)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)OC2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC(=CC(=C4)C(=O)O)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C22H12N2O9/c25-19-17-5-4-16(33-15-3-1-2-13(9-15)24(31)32)10-18(17)20(26)23(19)14-7-11(21(27)28)6-12(8-14)22(29)30/h1-10H,(H,27,28)(H,29,30)