2-[[(2-bromanyl-5-fluoranyl-phenyl)carbonylamino]methyl]-4-nitro-phenolate

Systemtic Name: 2-[[(2-bromanyl-5-fluoranyl-phenyl)carbonylamino]methyl]-4-nitro-phenolate Openeye Name: 2-[[(2-bromo-5-fluoro-benzoyl)amino]methyl]-4-nitro-phenolate CAS Name: 2-[[[(2-bromo-5-fluorophenyl)-oxomethyl]amino]methyl]-4-nitrophenolate IUPAC Name: 2-[[(2-bromo-5-fluorobenzoyl)amino]methyl]-4-nitrophenolate Traditional Name: 2-[[(2-bromo-5-fluoro-benzoyl)amino]methyl]-4-nitro-phenolate Formula: C14H9BrFN2O4- MolecularWeight: 368.134663

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H10BrFN2O4/c15-12-3-1-9(16)6-11(12)14(20)17-7-8-5-10(18(21)22)2-4-13(8)19/h1-6,19H,7H2,(H,17,20)/p-1