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

Systemtic Name: 2-[3-(2-oxidanylpropyl)pyridin-1-ium-1-yl]ethanoic acid; 2-(trimethylazaniumyl)ethanoate Openeye Name: 2-[3-(2-hydroxypropyl)pyridin-1-ium-1-yl]acetic acid; 2-(trimethylammonio)acetate CAS Name: 2-[3-(2-hydroxypropyl)-1-pyridin-1-iumyl]acetic acid; 2-(trimethylammonio)acetate IUPAC Name: 2-[3-(2-hydroxypropyl)pyridin-1-ium-1-yl]acetic acid; 2-(trimethylazaniumyl)acetate Traditional Name: 2-[3-(2-hydroxypropyl)pyridin-1-ium-1-yl]acetic acid; 2-(trimethylammonio)acetate Formula: C15H25N2O5+ MolecularWeight: 313.3694

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H13NO3.C5H11NO2/c1-8(12)5-9-3-2-4-11(6-9)7-10(13)14;1-6(2,3)4-5(7)8/h2-4,6,8,12H,5,7H2,1H3;4H2,1-3H3/p+1