4-[4-[2-(3-nitrophenyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylphenoxy]benzoic acid

Systemtic Name: 4-[4-[2-(3-nitrophenyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylphenoxy]benzoic acid Openeye Name: 4-[4-[2-(3-nitrophenyl)-1,3-dioxo-isoindoline-5-carbonyl]phenoxy]benzoic acid CAS Name: 4-[4-[[2-(3-nitrophenyl)-1,3-dioxo-5-isoindolyl]-oxomethyl]phenoxy]benzoic acid IUPAC Name: 4-[4-[2-(3-nitrophenyl)-1,3-dioxoisoindole-5-carbonyl]phenoxy]benzoic acid Traditional Name: 4-[4-[1,3-diketo-2-(3-nitrophenyl)isoindoline-5-carbonyl]phenoxy]benzoic acid Formula: C28H16N2O8 MolecularWeight: 508.43524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)C4=CC=C(C=C4)OC5=CC=C(C=C5)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)C4=CC=C(C=C4)OC5=CC=C(C=C5)C(=O)O

InChI

InChI=1S/C28H16N2O8/c31-25(16-4-9-21(10-5-16)38-22-11-6-17(7-12-22)28(34)35)18-8-13-23-24(14-18)27(33)29(26(23)32)19-2-1-3-20(15-19)30(36)37/h1-15H,(H,34,35)