4-(1-oxidanidylpyridin-1-ium-3-yl)benzoic acid

Systemtic Name: 4-(1-oxidanidylpyridin-1-ium-3-yl)benzoic acid Openeye Name: 4-(1-oxidopyridin-1-ium-3-yl)benzoic acid CAS Name: 4-(1-oxido-3-pyridin-1-iumyl)benzoic acid IUPAC Name: 4-(1-oxidopyridin-1-ium-3-yl)benzoic acid Traditional Name: 4-(1-oxidopyridin-1-ium-3-yl)benzoic acid Formula: C12H9NO3 MolecularWeight: 215.20476

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H9NO3/c14-12(15)10-5-3-9(4-6-10)11-2-1-7-13(16)8-11/h1-8H,(H,14,15)