4-[2-(1,3-benzodioxol-5-yl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylbenzoate

Systemtic Name: 4-[2-(1,3-benzodioxol-5-yl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylbenzoate Openeye Name: 4-[2-(1,3-benzodioxol-5-yl)-1,3-dioxo-isoindoline-5-carbonyl]benzoate CAS Name: 4-[[2-(1,3-benzodioxol-5-yl)-1,3-dioxo-5-isoindolyl]-oxomethyl]benzoate IUPAC Name: 4-[2-(1,3-benzodioxol-5-yl)-1,3-dioxoisoindole-5-carbonyl]benzoate Traditional Name: 4-[2-(1,3-benzodioxol-5-yl)-1,3-diketo-isoindoline-5-carbonyl]benzoate Formula: C23H12NO7- MolecularWeight: 414.34388

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)C5=CC=C(C=C5)C(=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)C5=CC=C(C=C5)C(=O)[O-]

InChI

InChI=1S/C23H13NO7/c25-20(12-1-3-13(4-2-12)23(28)29)14-5-7-16-17(9-14)22(27)24(21(16)26)15-6-8-18-19(10-15)31-11-30-18/h1-10H,11H2,(H,28,29)/p-1