2-[(4-nitro-1H-pyrrol-2-yl)carbonylamino]benzoate

Systemtic Name: 2-[(4-nitro-1H-pyrrol-2-yl)carbonylamino]benzoate Openeye Name: 2-[(4-nitro-1H-pyrrole-2-carbonyl)amino]benzoate CAS Name: 2-[[(4-nitro-1H-pyrrol-2-yl)-oxomethyl]amino]benzoate IUPAC Name: 2-[(4-nitro-1H-pyrrole-2-carbonyl)amino]benzoate Traditional Name: 2-[(4-nitro-1H-pyrrole-2-carbonyl)amino]benzoate Formula: C12H8N3O5- MolecularWeight: 274.20902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H9N3O5/c16-11(10-5-7(6-13-10)15(19)20)14-9-4-2-1-3-8(9)12(17)18/h1-6,13H,(H,14,16)(H,17,18)/p-1