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

Systemtic Name: bis[(2-nitrophenyl)methyl] piperazine-1,2-dicarboxylate Openeye Name: bis[(2-nitrophenyl)methyl] piperazine-1,2-dicarboxylate CAS Name: piperazine-1,2-dicarboxylic acid bis[(2-nitrophenyl)methyl] ester IUPAC Name: bis[(2-nitrophenyl)methyl] piperazine-1,2-dicarboxylate Traditional Name: piperazine-1,2-dicarboxylic acid bis(2-nitrobenzyl) ester Formula: C20H20N4O8 MolecularWeight: 444.3948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1)C(=O)OCC2=CC=CC=C2[N+](=O)[O-])C(=O)OCC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CN(C(CN1)C(=O)OCC2=CC=CC=C2[N+](=O)[O-])C(=O)OCC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O8/c25-19(31-12-14-5-1-3-7-16(14)23(27)28)18-11-21-9-10-22(18)20(26)32-13-15-6-2-4-8-17(15)24(29)30/h1-8,18,21H,9-13H2