2-[(4-nitrophenyl)methyl]propanedioate

Systemtic Name: 2-[(4-nitrophenyl)methyl]propanedioate Openeye Name: 2-[(4-nitrophenyl)methyl]propanedioate CAS Name: 2-[(4-nitrophenyl)methyl]propanedioate IUPAC Name: 2-[(4-nitrophenyl)methyl]propanedioate Traditional Name: 2-(4-nitrobenzyl)malonate Formula: C10H7NO6-2 MolecularWeight: 237.16568

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9NO6/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)/p-2