3-(5-nitropyridin-2-yl)benzoic acid

Systemtic Name: 3-(5-nitropyridin-2-yl)benzoic acid Openeye Name: 3-(5-nitro-2-pyridyl)benzoic acid CAS Name: 3-(5-nitro-2-pyridinyl)benzoic acid IUPAC Name: 3-(5-nitropyridin-2-yl)benzoic acid Traditional Name: 3-(5-nitro-2-pyridyl)benzoic acid Formula: C12H8N2O4 MolecularWeight: 244.20292

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H8N2O4/c15-12(16)9-3-1-2-8(6-9)11-5-4-10(7-13-11)14(17)18/h1-7H,(H,15,16)