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

Systemtic Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-(3,4-dichlorophenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-(3,4-dichlorophenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(3,4-dichlorophenyl)-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-(3,4-dichlorophenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-(3,4-dichlorophenyl)-1,3-diketo-isoindoline-5-carboxylic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C24H14Cl2N2O8 MolecularWeight: 529.28256

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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)C5=CC(=C(C=C5)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)COC(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)C5=CC(=C(C=C5)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C24H14Cl2N2O8/c25-19-4-2-15(8-20(19)26)27-22(29)17-3-1-12(7-18(17)23(27)30)24(31)35-10-14-6-16(28(32)33)5-13-9-34-11-36-21(13)14/h1-8H,9-11H2