magnesium 2-[(4-nitrophenyl)methyl]propanedioate

Systemtic Name: magnesium 2-[(4-nitrophenyl)methyl]propanedioate Openeye Name: magnesium 2-[(4-nitrophenyl)methyl]propanedioate CAS Name: magnesium 2-[(4-nitrophenyl)methyl]propanedioate IUPAC Name: magnesium 2-[(4-nitrophenyl)methyl]propanedioate Traditional Name: magnesium 2-(4-nitrobenzyl)malonate Formula: C10H7MgNO6 MolecularWeight: 261.47068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)[O-])C(=O)[O-])[N+](=O)[O-].[Mg+2]

Isomeric SMILES

C1=CC(=CC=C1CC(C(=O)[O-])C(=O)[O-])[N+](=O)[O-].[Mg+2]

InChI

InChI=1S/C10H9NO6.Mg/c12-9(13)8(10(14)15)5-6-1-3-7(4-2-6)11(16)17;/h1-4,8H,5H2,(H,12,13)(H,14,15);/q;+2/p-2