1,2-dimethyl-3-[3-(2-methylimidazol-1-yl)propyl]imidazol-1-ium bromide

Systemtic Name: 1,2-dimethyl-3-[3-(2-methylimidazol-1-yl)propyl]imidazol-1-ium bromide Openeye Name: 1,2-dimethyl-3-[3-(2-methylimidazol-1-yl)propyl]imidazol-1-ium bromide CAS Name: 1,2-dimethyl-3-[3-(2-methyl-1-imidazolyl)propyl]imidazol-1-ium bromide IUPAC Name: 1,2-dimethyl-3-[3-(2-methylimidazol-1-yl)propyl]imidazol-1-ium bromide Traditional Name: 1,2-dimethyl-3-[3-(2-methylimidazol-1-yl)propyl]imidazol-1-ium bromide Formula: C12H19BrN4 MolecularWeight: 299.21006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN1CCCN2C=C[N+](=C2C)C.[Br-]

Isomeric SMILES

CC1=NC=CN1CCCN2C=C[N+](=C2C)C.[Br-]

InChI

InChI=1S/C12H19N4.BrH/c1-11-13-5-8-15(11)6-4-7-16-10-9-14(3)12(16)2;/h5,8-10H,4,6-7H2,1-3H3;1H/q+1;/p-1