(6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-(furan-2-ylmethyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-(furan-2-ylmethyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-(2-furylmethyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(2-furanylmethyl)-1,3-dioxo-5-isoindolecarboxylic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-(furan-2-ylmethyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-(2-furfuryl)-1,3-diketo-isoindoline-5-carboxylic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C23H16N2O9 MolecularWeight: 464.38114

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)COC(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CC5=CC=CO5)[N+](=O)[O-]

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)COC(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CC5=CC=CO5)[N+](=O)[O-]

InChI

InChI=1S/C23H16N2O9/c26-21-18-4-3-13(8-19(18)22(27)24(21)9-17-2-1-5-32-17)23(28)33-11-15-7-16(25(29)30)6-14-10-31-12-34-20(14)15/h1-8H,9-12H2