bis[(3-nitrophenyl)methyl] 5-(hydroxymethyl)benzene-1,3-dicarboxylate

Systemtic Name: bis[(3-nitrophenyl)methyl] 5-(hydroxymethyl)benzene-1,3-dicarboxylate Openeye Name: bis[(3-nitrophenyl)methyl] 5-(hydroxymethyl)benzene-1,3-dicarboxylate CAS Name: 5-(hydroxymethyl)benzene-1,3-dicarboxylic acid bis[(3-nitrophenyl)methyl] ester IUPAC Name: bis[(3-nitrophenyl)methyl] 5-(hydroxymethyl)benzene-1,3-dicarboxylate Traditional Name: 5-methylolbenzene-1,3-dicarboxylic acid bis(3-nitrobenzyl) ester Formula: C23H18N2O9 MolecularWeight: 466.39702

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H18N2O9/c26-12-17-7-18(22(27)33-13-15-3-1-5-20(9-15)24(29)30)11-19(8-17)23(28)34-14-16-4-2-6-21(10-16)25(31)32/h1-11,26H,12-14H2