bis[(4,5-dimethoxy-2-nitro-phenyl)methyl] 3-oxidanylidenepentanedioate

Systemtic Name: bis[(4,5-dimethoxy-2-nitro-phenyl)methyl] 3-oxidanylidenepentanedioate Openeye Name: bis[(4,5-dimethoxy-2-nitro-phenyl)methyl] 3-oxopentanedioate CAS Name: 3-oxopentanedioic acid bis[(4,5-dimethoxy-2-nitrophenyl)methyl] ester IUPAC Name: bis[(4,5-dimethoxy-2-nitrophenyl)methyl] 3-oxopentanedioate Traditional Name: 3-ketoglutaric acid bis(4,5-dimethoxy-2-nitro-benzyl) ester Formula: C23H24N2O13 MolecularWeight: 536.44226

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)COC(=O)CC(=O)CC(=O)OCC2=CC(=C(C=C2[N+](=O)[O-])OC)OC)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)COC(=O)CC(=O)CC(=O)OCC2=CC(=C(C=C2[N+](=O)[O-])OC)OC)[N+](=O)[O-])OC

InChI

InChI=1S/C23H24N2O13/c1-33-18-5-13(16(24(29)30)9-20(18)35-3)11-37-22(27)7-15(26)8-23(28)38-12-14-6-19(34-2)21(36-4)10-17(14)25(31)32/h5-6,9-10H,7-8,11-12H2,1-4H3