dibutyl-methyl-[(3-oxidanylpyridin-2-yl)methyl]azanium; N,N-dimethylcarbamate; hydrobromide

Systemtic Name: dibutyl-methyl-[(3-oxidanylpyridin-2-yl)methyl]azanium; N,N-dimethylcarbamate; hydrobromide Openeye Name: dibutyl-[(3-hydroxy-2-pyridyl)methyl]-methyl-ammonium; N,N-dimethylcarbamate; hydrobromide CAS Name: dibutyl-[(3-hydroxy-2-pyridinyl)methyl]-methylammonium; N,N-dimethylcarbamate; hydrobromide IUPAC Name: dibutyl-[(3-hydroxypyridin-2-yl)methyl]-methylazanium; N,N-dimethylcarbamate; hydrobromide Traditional Name: dibutyl-[(3-hydroxy-2-pyridyl)methyl]-methyl-ammonium; N,N-dimethylcarbamate; hydrobromide Formula: C18H34BrN3O3 MolecularWeight: 420.38486

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](C)(CCCC)CC1=C(C=CC=N1)O.CN(C)C(=O)[O-].Br

Isomeric SMILES

CCCC[N+](C)(CCCC)CC1=C(C=CC=N1)O.CN(C)C(=O)[O-].Br

InChI

InChI=1S/C15H26N2O.C3H7NO2.BrH/c1-4-6-11-17(3,12-7-5-2)13-14-15(18)9-8-10-16-14;1-4(2)3(5)6;/h8-10H,4-7,11-13H2,1-3H3;1-2H3,(H,5,6);1H