bis[(4-nitrophenyl)methyl] 3-oxidanylpentanedioate

Systemtic Name: bis[(4-nitrophenyl)methyl] 3-oxidanylpentanedioate Openeye Name: bis[(4-nitrophenyl)methyl] 3-hydroxypentanedioate CAS Name: 3-hydroxypentanedioic acid bis[(4-nitrophenyl)methyl] ester IUPAC Name: bis[(4-nitrophenyl)methyl] 3-hydroxypentanedioate Traditional Name: 3-hydroxyglutaric acid bis(4-nitrobenzyl) ester Formula: C19H18N2O9 MolecularWeight: 418.35422

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC(=O)CC(CC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1COC(=O)CC(CC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])O)[N+](=O)[O-]

InChI

InChI=1S/C19H18N2O9/c22-17(9-18(23)29-11-13-1-5-15(6-2-13)20(25)26)10-19(24)30-12-14-3-7-16(8-4-14)21(27)28/h1-8,17,22H,9-12H2