2-(4-fluoranyl-2-nitro-phenyl)propanedioic acid

Systemtic Name: 2-(4-fluoranyl-2-nitro-phenyl)propanedioic acid Openeye Name: 2-(4-fluoro-2-nitro-phenyl)propanedioic acid CAS Name: 2-(4-fluoro-2-nitrophenyl)propanedioic acid IUPAC Name: 2-(4-fluoro-2-nitrophenyl)propanedioic acid Traditional Name: 2-(4-fluoro-2-nitro-phenyl)malonic acid Formula: C9H6FNO6 MolecularWeight: 243.145443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)[N+](=O)[O-])C(C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1F)[N+](=O)[O-])C(C(=O)O)C(=O)O

InChI

InChI=1S/C9H6FNO6/c10-4-1-2-5(6(3-4)11(16)17)7(8(12)13)9(14)15/h1-3,7H,(H,12,13)(H,14,15)