2-[(4-fluoranyl-2-nitro-phenyl)amino]hexanoic acid

Systemtic Name: 2-[(4-fluoranyl-2-nitro-phenyl)amino]hexanoic acid Openeye Name: 2-(4-fluoro-2-nitro-anilino)hexanoic acid CAS Name: 2-(4-fluoro-2-nitroanilino)hexanoic acid IUPAC Name: 2-(4-fluoro-2-nitroanilino)hexanoic acid Traditional Name: 2-(4-fluoro-2-nitro-anilino)hexanoic acid Formula: C12H15FN2O4 MolecularWeight: 270.256903

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NC1=C(C=C(C=C1)F)[N+](=O)[O-]

Isomeric SMILES

CCCCC(C(=O)O)NC1=C(C=C(C=C1)F)[N+](=O)[O-]

InChI

InChI=1S/C12H15FN2O4/c1-2-3-4-10(12(16)17)14-9-6-5-8(13)7-11(9)15(18)19/h5-7,10,14H,2-4H2,1H3,(H,16,17)