3-[5,6-dimethyl-1-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazol-2-yl]propylazanium

Systemtic Name: 3-[5,6-dimethyl-1-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazol-2-yl]propylazanium Openeye Name: 3-[5,6-dimethyl-1-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazol-2-yl]propylammonium CAS Name: 3-[5,6-dimethyl-1-[2-(1-pyrrolidin-1-iumyl)ethyl]-2-benzimidazolyl]propylammonium IUPAC Name: 3-[5,6-dimethyl-1-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazol-2-yl]propylazanium Traditional Name: 3-[5,6-dimethyl-1-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazol-2-yl]propylammonium Formula: C18H30N4+2 MolecularWeight: 302.4576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C(=N2)CCC[NH3+])CC[NH+]3CCCC3

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C(=N2)CCC[NH3+])CC[NH+]3CCCC3

InChI

InChI=1S/C18H28N4/c1-14-12-16-17(13-15(14)2)22(18(20-16)6-5-7-19)11-10-21-8-3-4-9-21/h12-13H,3-11,19H2,1-2H3/p+2