3-[2-[(1S)-1-azaniumylethyl]-5,6-dimethyl-benzimidazol-1-yl]propyl-dimethyl-azanium

Systemtic Name: 3-[2-[(1S)-1-azaniumylethyl]-5,6-dimethyl-benzimidazol-1-yl]propyl-dimethyl-azanium Openeye Name: 3-[2-[(1S)-1-azaniumylethyl]-5,6-dimethyl-benzimidazol-1-yl]propyl-dimethyl-ammonium CAS Name: 3-[2-[(1S)-1-ammonioethyl]-5,6-dimethyl-1-benzimidazolyl]propyl-dimethylammonium IUPAC Name: 3-[2-[(1S)-1-azaniumylethyl]-5,6-dimethylbenzimidazol-1-yl]propyl-dimethylazanium Traditional Name: 3-[2-[(1S)-1-ammonioethyl]-5,6-dimethyl-benzimidazol-1-yl]propyl-dimethyl-ammonium Formula: C16H28N4+2 MolecularWeight: 276.42032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C(=N2)C(C)[NH3+])CCC[NH+](C)C

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C(=N2)[C@H](C)[NH3+])CCC[NH+](C)C

InChI

InChI=1S/C16H26N4/c1-11-9-14-15(10-12(11)2)20(8-6-7-19(4)5)16(18-14)13(3)17/h9-10,13H,6-8,17H2,1-5H3/p+2/t13-/m0/s1