(Z)-2-[(4-nitrophenyl)methyl]but-2-enedioic acid

Systemtic Name: (Z)-2-[(4-nitrophenyl)methyl]but-2-enedioic acid Openeye Name: (Z)-2-[(4-nitrophenyl)methyl]but-2-enedioic acid CAS Name: (Z)-2-[(4-nitrophenyl)methyl]-2-butenedioic acid IUPAC Name: (Z)-2-[(4-nitrophenyl)methyl]but-2-enedioic acid Traditional Name: (Z)-2-(4-nitrobenzyl)but-2-enedioic acid Formula: C11H9NO6 MolecularWeight: 251.19226

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC(=CC=C1C/C(=C/C(=O)O)/C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C11H9NO6/c13-10(14)6-8(11(15)16)5-7-1-3-9(4-2-7)12(17)18/h1-4,6H,5H2,(H,13,14)(H,15,16)/b8-6-