2-(3-oxidanylpyridin-1-ium-1-yl)butanoic acid

Systemtic Name: 2-(3-oxidanylpyridin-1-ium-1-yl)butanoic acid Openeye Name: 2-(3-hydroxypyridin-1-ium-1-yl)butanoic acid CAS Name: 2-(3-hydroxy-1-pyridin-1-iumyl)butanoic acid IUPAC Name: 2-(3-hydroxypyridin-1-ium-1-yl)butanoic acid Traditional Name: 2-(3-hydroxypyridin-1-ium-1-yl)butyric acid Formula: C9H12NO3+ MolecularWeight: 182.19648

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)[N+]1=CC=CC(=C1)O

Isomeric SMILES

CCC(C(=O)O)[N+]1=CC=CC(=C1)O

InChI

InChI=1S/C9H11NO3/c1-2-8(9(12)13)10-5-3-4-7(11)6-10/h3-6,8H,2H2,1H3,(H-,11,12,13)/p+1