1-methyl-3-(phenylmethyl)-2-undecyl-imidazol-1-ium bromide

Systemtic Name: 1-methyl-3-(phenylmethyl)-2-undecyl-imidazol-1-ium bromide Openeye Name: 1-benzyl-3-methyl-2-undecyl-imidazol-3-ium bromide CAS Name: 1-methyl-3-(phenylmethyl)-2-undecylimidazol-1-ium bromide IUPAC Name: 1-benzyl-3-methyl-2-undecylimidazol-3-ium bromide Traditional Name: 1-benzyl-3-methyl-2-undecyl-imidazol-3-ium bromide Formula: C22H35BrN2 MolecularWeight: 407.4307

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=[N+](C=CN1CC2=CC=CC=C2)C.[Br-]

Isomeric SMILES

CCCCCCCCCCCC1=[N+](C=CN1CC2=CC=CC=C2)C.[Br-]

InChI

InChI=1S/C22H35N2.BrH/c1-3-4-5-6-7-8-9-10-14-17-22-23(2)18-19-24(22)20-21-15-12-11-13-16-21;/h11-13,15-16,18-19H,3-10,14,17,20H2,1-2H3;1H/q+1;/p-1