N,N-dimethylcarbamate; 3-[2-(1-methylpyridin-1-ium-2-yl)ethyl]phenol; hydroiodide

Systemtic Name: N,N-dimethylcarbamate; 3-[2-(1-methylpyridin-1-ium-2-yl)ethyl]phenol; hydroiodide Openeye Name: N,N-dimethylcarbamate; 3-[2-(1-methylpyridin-1-ium-2-yl)ethyl]phenol; hydroiodide CAS Name: N,N-dimethylcarbamate; 3-[2-(1-methyl-2-pyridin-1-iumyl)ethyl]phenol; hydroiodide IUPAC Name: N,N-dimethylcarbamate; 3-[2-(1-methylpyridin-1-ium-2-yl)ethyl]phenol; hydroiodide Traditional Name: N,N-dimethylcarbamate; 3-[2-(1-methylpyridin-1-ium-2-yl)ethyl]phenol; hydroiodide Formula: C17H23IN2O3 MolecularWeight: 430.28059

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC=C1CCC2=CC(=CC=C2)O.CN(C)C(=O)[O-].I

Isomeric SMILES

C[N+]1=CC=CC=C1CCC2=CC(=CC=C2)O.CN(C)C(=O)[O-].I

InChI

InChI=1S/C14H15NO.C3H7NO2.HI/c1-15-10-3-2-6-13(15)9-8-12-5-4-7-14(16)11-12;1-4(2)3(5)6;/h2-7,10-11H,8-9H2,1H3;1-2H3,(H,5,6);1H