2-fluoranyl-6-[(4-nitro-1H-pyrrol-2-yl)carbonylamino]benzoic acid

Systemtic Name: 2-fluoranyl-6-[(4-nitro-1H-pyrrol-2-yl)carbonylamino]benzoic acid Openeye Name: 2-fluoro-6-[(4-nitro-1H-pyrrole-2-carbonyl)amino]benzoic acid CAS Name: 2-fluoro-6-[[(4-nitro-1H-pyrrol-2-yl)-oxomethyl]amino]benzoic acid IUPAC Name: 2-fluoro-6-[(4-nitro-1H-pyrrole-2-carbonyl)amino]benzoic acid Traditional Name: 2-fluoro-6-[(4-nitro-1H-pyrrole-2-carbonyl)amino]benzoic acid Formula: C12H8FN3O5 MolecularWeight: 293.207423

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)F)C(=O)O)NC(=O)C2=CC(=CN2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C(=C1)F)C(=O)O)NC(=O)C2=CC(=CN2)[N+](=O)[O-]

InChI

InChI=1S/C12H8FN3O5/c13-7-2-1-3-8(10(7)12(18)19)15-11(17)9-4-6(5-14-9)16(20)21/h1-5,14H,(H,15,17)(H,18,19)