2-nitro-5-(pyridin-3-ylamino)benzoate

Systemtic Name: 2-nitro-5-(pyridin-3-ylamino)benzoate Openeye Name: 2-nitro-5-(3-pyridylamino)benzoate CAS Name: 2-nitro-5-(3-pyridinylamino)benzoate IUPAC Name: 2-nitro-5-(pyridin-3-ylamino)benzoate Traditional Name: 2-nitro-5-(3-pyridylamino)benzoate Formula: C12H8N3O4- MolecularWeight: 258.20962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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