bis[(2-nitrophenyl)methyl] benzene-1,4-dicarboxylate

Systemtic Name: bis[(2-nitrophenyl)methyl] benzene-1,4-dicarboxylate Openeye Name: bis[(2-nitrophenyl)methyl] benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid bis[(2-nitrophenyl)methyl] ester IUPAC Name: bis[(2-nitrophenyl)methyl] benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid bis(2-nitrobenzyl) ester Formula: C22H16N2O8 MolecularWeight: 436.37104

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC(=O)C2=CC=C(C=C2)C(=O)OCC3=CC=CC=C3[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)COC(=O)C2=CC=C(C=C2)C(=O)OCC3=CC=CC=C3[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H16N2O8/c25-21(31-13-17-5-1-3-7-19(17)23(27)28)15-9-11-16(12-10-15)22(26)32-14-18-6-2-4-8-20(18)24(29)30/h1-12H,13-14H2