ethyl 2-(2-butyl-3-methyl-benzimidazol-3-ium-1-yl)ethanoate bromide

Systemtic Name: ethyl 2-(2-butyl-3-methyl-benzimidazol-3-ium-1-yl)ethanoate bromide Openeye Name: ethyl 2-(2-butyl-3-methyl-benzimidazol-3-ium-1-yl)acetate bromide CAS Name: 2-(2-butyl-3-methyl-1-benzimidazol-3-iumyl)acetic acid ethyl ester bromide IUPAC Name: ethyl 2-(2-butyl-3-methylbenzimidazol-3-ium-1-yl)acetate bromide Traditional Name: 2-(2-butyl-3-methyl-benzimidazol-3-ium-1-yl)acetic acid ethyl ester bromide Formula: C16H23BrN2O2 MolecularWeight: 355.27002

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=[N+](C2=CC=CC=C2N1CC(=O)OCC)C.[Br-]

Isomeric SMILES

CCCCC1=[N+](C2=CC=CC=C2N1CC(=O)OCC)C.[Br-]

InChI

InChI=1S/C16H23N2O2.BrH/c1-4-6-11-15-17(3)13-9-7-8-10-14(13)18(15)12-16(19)20-5-2;/h7-10H,4-6,11-12H2,1-3H3;1H/q+1;/p-1