5-nitro-2-(pyridin-3-ylcarbonylamino)benzoic acid

Systemtic Name: 5-nitro-2-(pyridin-3-ylcarbonylamino)benzoic acid Openeye Name: 5-nitro-2-(pyridine-3-carbonylamino)benzoic acid CAS Name: 5-nitro-2-[[oxo(3-pyridinyl)methyl]amino]benzoic acid IUPAC Name: 5-nitro-2-(pyridine-3-carbonylamino)benzoic acid Traditional Name: 2-nicotinamido-5-nitro-benzoic acid Formula: C13H9N3O5 MolecularWeight: 287.22766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H9N3O5/c17-12(8-2-1-5-14-7-8)15-11-4-3-9(16(20)21)6-10(11)13(18)19/h1-7H,(H,15,17)(H,18,19)