3-nitro-2-(pyridin-3-ylcarbamoyl)benzoate

Systemtic Name: 3-nitro-2-(pyridin-3-ylcarbamoyl)benzoate Openeye Name: 3-nitro-2-(3-pyridylcarbamoyl)benzoate CAS Name: 3-nitro-2-[oxo-(3-pyridinylamino)methyl]benzoate IUPAC Name: 3-nitro-2-(pyridin-3-ylcarbamoyl)benzoate Traditional Name: 3-nitro-2-(3-pyridylcarbamoyl)benzoate Formula: C13H8N3O5- MolecularWeight: 286.21972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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