2-[(5-nitropyridin-3-yl)carbamoyl]benzoic acid

Systemtic Name: 2-[(5-nitropyridin-3-yl)carbamoyl]benzoic acid Openeye Name: 2-[(5-nitro-3-pyridyl)carbamoyl]benzoic acid CAS Name: 2-[[(5-nitro-3-pyridinyl)amino]-oxomethyl]benzoic acid IUPAC Name: 2-[(5-nitropyridin-3-yl)carbamoyl]benzoic acid Traditional Name: 2-[(5-nitro-3-pyridyl)carbamoyl]benzoic acid Formula: C13H9N3O5 MolecularWeight: 287.22766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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