[(1S)-3-methyl-1-[1-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazol-2-yl]butyl]azanium

Systemtic Name: [(1S)-3-methyl-1-[1-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazol-2-yl]butyl]azanium Openeye Name: [(1S)-3-methyl-1-[1-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazol-2-yl]butyl]ammonium CAS Name: [(1S)-3-methyl-1-[1-[2-(1-pyrrolidin-1-iumyl)ethyl]-2-benzimidazolyl]butyl]ammonium IUPAC Name: [(1S)-3-methyl-1-[1-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazol-2-yl]butyl]azanium Traditional Name: [(1S)-3-methyl-1-[1-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazol-2-yl]butyl]ammonium Formula: C18H30N4+2 MolecularWeight: 302.4576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=NC2=CC=CC=C2N1CC[NH+]3CCCC3)[NH3+]

Isomeric SMILES

CC(C)C[C@@H](C1=NC2=CC=CC=C2N1CC[NH+]3CCCC3)[NH3+]

InChI

InChI=1S/C18H28N4/c1-14(2)13-15(19)18-20-16-7-3-4-8-17(16)22(18)12-11-21-9-5-6-10-21/h3-4,7-8,14-15H,5-6,9-13,19H2,1-2H3/p+2/t15-/m0/s1