(1-hexylpyridin-1-ium-3-yl) N,N-dimethylcarbamate bromide

Systemtic Name: (1-hexylpyridin-1-ium-3-yl) N,N-dimethylcarbamate bromide Openeye Name: (1-hexylpyridin-1-ium-3-yl) N,N-dimethylcarbamate bromide CAS Name: N,N-dimethylcarbamic acid (1-hexyl-3-pyridin-1-iumyl) ester bromide IUPAC Name: (1-hexylpyridin-1-ium-3-yl) N,N-dimethylcarbamate bromide Traditional Name: N,N-dimethylcarbamic acid (1-hexylpyridin-1-ium-3-yl) ester bromide Formula: C14H23BrN2O2 MolecularWeight: 331.24862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[N+]1=CC=CC(=C1)OC(=O)N(C)C.[Br-]

Isomeric SMILES

CCCCCC[N+]1=CC=CC(=C1)OC(=O)N(C)C.[Br-]

InChI

InChI=1S/C14H23N2O2.BrH/c1-4-5-6-7-10-16-11-8-9-13(12-16)18-14(17)15(2)3;/h8-9,11-12H,4-7,10H2,1-3H3;1H/q+1;/p-1