3-[2-[(1S)-1-azaniumyl-3-methyl-butyl]benzimidazol-1-yl]propyl-dimethyl-azanium

Systemtic Name: 3-[2-[(1S)-1-azaniumyl-3-methyl-butyl]benzimidazol-1-yl]propyl-dimethyl-azanium Openeye Name: 3-[2-[(1S)-1-azaniumyl-3-methyl-butyl]benzimidazol-1-yl]propyl-dimethyl-ammonium CAS Name: 3-[2-[(1S)-1-ammonio-3-methylbutyl]-1-benzimidazolyl]propyl-dimethylammonium IUPAC Name: 3-[2-[(1S)-1-azaniumyl-3-methylbutyl]benzimidazol-1-yl]propyl-dimethylazanium Traditional Name: 3-[2-[(1S)-1-ammonio-3-methyl-butyl]benzimidazol-1-yl]propyl-dimethyl-ammonium Formula: C17H30N4+2 MolecularWeight: 290.4469

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=NC2=CC=CC=C2N1CCC[NH+](C)C)[NH3+]

Isomeric SMILES

CC(C)C[C@@H](C1=NC2=CC=CC=C2N1CCC[NH+](C)C)[NH3+]

InChI

InChI=1S/C17H28N4/c1-13(2)12-14(18)17-19-15-8-5-6-9-16(15)21(17)11-7-10-20(3)4/h5-6,8-9,13-14H,7,10-12,18H2,1-4H3/p+2/t14-/m0/s1