2-[3-(2-oxidanylpropyl)pyridin-1-ium-1-yl]ethanoic acid

Systemtic Name: 2-[3-(2-oxidanylpropyl)pyridin-1-ium-1-yl]ethanoic acid Openeye Name: 2-[3-(2-hydroxypropyl)pyridin-1-ium-1-yl]acetic acid CAS Name: 2-[3-(2-hydroxypropyl)-1-pyridin-1-iumyl]acetic acid IUPAC Name: 2-[3-(2-hydroxypropyl)pyridin-1-ium-1-yl]acetic acid Traditional Name: 2-[3-(2-hydroxypropyl)pyridin-1-ium-1-yl]acetic acid Formula: C10H14NO3+ MolecularWeight: 196.22306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H13NO3/c1-8(12)5-9-3-2-4-11(6-9)7-10(13)14/h2-4,6,8,12H,5,7H2,1H3/p+1