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

Systemtic Name: 2-[(2-fluoranyl-4-nitro-phenyl)amino]hexanoic acid Openeye Name: 2-(2-fluoro-4-nitro-anilino)hexanoic acid CAS Name: 2-(2-fluoro-4-nitroanilino)hexanoic acid IUPAC Name: 2-(2-fluoro-4-nitroanilino)hexanoic acid Traditional Name: 2-(2-fluoro-4-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)[N+](=O)[O-])F

Isomeric SMILES

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

InChI

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