4-[(6-nitropyridin-3-yl)amino]benzoate

Systemtic Name: 4-[(6-nitropyridin-3-yl)amino]benzoate Openeye Name: 4-[(6-nitro-3-pyridyl)amino]benzoate CAS Name: 4-[(6-nitro-3-pyridinyl)amino]benzoate IUPAC Name: 4-[(6-nitropyridin-3-yl)amino]benzoate Traditional Name: 4-[(6-nitro-3-pyridyl)amino]benzoate Formula: C12H8N3O4- MolecularWeight: 258.20962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)[O-])NC2=CN=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)[O-])NC2=CN=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H9N3O4/c16-12(17)8-1-3-9(4-2-8)14-10-5-6-11(13-7-10)15(18)19/h1-7,14H,(H,16,17)/p-1