2-(3-fluoranyl-4-nitro-phenyl)-2-methyl-propanedioic acid

Systemtic Name: 2-(3-fluoranyl-4-nitro-phenyl)-2-methyl-propanedioic acid Openeye Name: 2-(3-fluoro-4-nitro-phenyl)-2-methyl-propanedioic acid CAS Name: 2-(3-fluoro-4-nitrophenyl)-2-methylpropanedioic acid IUPAC Name: 2-(3-fluoro-4-nitrophenyl)-2-methylpropanedioic acid Traditional Name: 2-(3-fluoro-4-nitro-phenyl)-2-methyl-malonic acid Formula: C10H8FNO6 MolecularWeight: 257.172023

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H8FNO6/c1-10(8(13)14,9(15)16)5-2-3-7(12(17)18)6(11)4-5/h2-4H,1H3,(H,13,14)(H,15,16)