3-[5-[2-(3-carboxylatophenyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonyl-1,3-bis(oxidanylidene)isoindol-2-yl]benzoate

Systemtic Name: 3-[5-[2-(3-carboxylatophenyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonyl-1,3-bis(oxidanylidene)isoindol-2-yl]benzoate Openeye Name: 3-[5-[2-(3-carboxylatophenyl)-1,3-dioxo-isoindoline-5-carbonyl]-1,3-dioxo-isoindolin-2-yl]benzoate CAS Name: 3-[5-[[2-(3-carboxylatophenyl)-1,3-dioxo-5-isoindolyl]-oxomethyl]-1,3-dioxo-2-isoindolyl]benzoate IUPAC Name: 3-[5-[2-(3-carboxylatophenyl)-1,3-dioxoisoindole-5-carbonyl]-1,3-dioxoisoindol-2-yl]benzoate Traditional Name: 3-[5-[2-(3-carboxylatophenyl)-1,3-diketo-isoindoline-5-carbonyl]-1,3-diketo-isoindolin-2-yl]benzoate Formula: C31H14N2O9-2 MolecularWeight: 558.45086

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)C4=CC5=C(C=C4)C(=O)N(C5=O)C6=CC=CC(=C6)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)C4=CC5=C(C=C4)C(=O)N(C5=O)C6=CC=CC(=C6)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C31H16N2O9/c34-25(15-7-9-21-23(13-15)28(37)32(26(21)35)19-5-1-3-17(11-19)30(39)40)16-8-10-22-24(14-16)29(38)33(27(22)36)20-6-2-4-18(12-20)31(41)42/h1-14H,(H,39,40)(H,41,42)/p-2