2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-5-nitro-benzoate

Systemtic Name: 2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-5-nitro-benzoate Openeye Name: 2-(4-bromo-2-fluoro-anilino)-5-nitro-benzoate CAS Name: 2-(4-bromo-2-fluoroanilino)-5-nitrobenzoate IUPAC Name: 2-(4-bromo-2-fluoroanilino)-5-nitrobenzoate Traditional Name: 2-(4-bromo-2-fluoro-anilino)-5-nitro-benzoate Formula: C13H7BrFN2O4- MolecularWeight: 354.108083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])C(=O)[O-])NC2=C(C=C(C=C2)Br)F

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])C(=O)[O-])NC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C13H8BrFN2O4/c14-7-1-3-12(10(15)5-7)16-11-4-2-8(17(20)21)6-9(11)13(18)19/h1-6,16H,(H,18,19)/p-1