2-(6-methyl-1-oxidanidyl-pyridin-1-ium-2-yl)ethanoic acid

Systemtic Name: 2-(6-methyl-1-oxidanidyl-pyridin-1-ium-2-yl)ethanoic acid Openeye Name: 2-(6-methyl-1-oxido-pyridin-1-ium-2-yl)acetic acid CAS Name: 2-(6-methyl-1-oxido-2-pyridin-1-iumyl)acetic acid IUPAC Name: 2-(6-methyl-1-oxidopyridin-1-ium-2-yl)acetic acid Traditional Name: 2-(6-methyl-1-oxido-pyridin-1-ium-2-yl)acetic acid Formula: C8H9NO3 MolecularWeight: 167.16196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=CC=C1)CC(=O)O)[O-]

Isomeric SMILES

CC1=[N+](C(=CC=C1)CC(=O)O)[O-]

InChI

InChI=1S/C8H9NO3/c1-6-3-2-4-7(9(6)12)5-8(10)11/h2-4H,5H2,1H3,(H,10,11)