1-(2,3-dipropylbenzimidazol-1-ium-1-yl)-3,3-dimethyl-butan-2-one bromide

Systemtic Name: 1-(2,3-dipropylbenzimidazol-1-ium-1-yl)-3,3-dimethyl-butan-2-one bromide Openeye Name: 1-(2,3-dipropylbenzimidazol-1-ium-1-yl)-3,3-dimethyl-butan-2-one bromide CAS Name: 1-(2,3-dipropyl-1-benzimidazol-1-iumyl)-3,3-dimethyl-2-butanone bromide IUPAC Name: 1-(2,3-dipropylbenzimidazol-1-ium-1-yl)-3,3-dimethylbutan-2-one bromide Traditional Name: 1-(2,3-dipropylbenzimidazol-1-ium-1-yl)-3,3-dimethyl-butan-2-one bromide Formula: C19H29BrN2O MolecularWeight: 381.35036

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=[N+](C2=CC=CC=C2N1CCC)CC(=O)C(C)(C)C.[Br-]

Isomeric SMILES

CCCC1=[N+](C2=CC=CC=C2N1CCC)CC(=O)C(C)(C)C.[Br-]

InChI

InChI=1S/C19H29N2O.BrH/c1-6-10-18-20(13-7-2)15-11-8-9-12-16(15)21(18)14-17(22)19(3,4)5;/h8-9,11-12H,6-7,10,13-14H2,1-5H3;1H/q+1;/p-1