N,N-diethyl-2-[1-(2-pyrrolidin-1-ylethyl)benzimidazol-1-ium-1-yl]ethanamine

Systemtic Name: N,N-diethyl-2-[1-(2-pyrrolidin-1-ylethyl)benzimidazol-1-ium-1-yl]ethanamine Openeye Name: N,N-diethyl-2-[1-(2-pyrrolidin-1-ylethyl)benzimidazol-1-ium-1-yl]ethanamine CAS Name: N,N-diethyl-2-[1-[2-(1-pyrrolidinyl)ethyl]-1-benzimidazol-1-iumyl]ethanamine IUPAC Name: N,N-diethyl-2-[1-(2-pyrrolidin-1-ylethyl)benzimidazol-1-ium-1-yl]ethanamine Traditional Name: diethyl-[2-[1-(2-pyrrolidinoethyl)benzimidazol-1-ium-1-yl]ethyl]amine Formula: C19H31N4+ MolecularWeight: 315.47624

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC[N+]1(C=NC2=CC=CC=C21)CCN3CCCC3

Isomeric SMILES

CCN(CC)CC[N+]1(C=NC2=CC=CC=C21)CCN3CCCC3

InChI

InChI=1S/C19H31N4/c1-3-21(4-2)13-15-23(16-14-22-11-7-8-12-22)17-20-18-9-5-6-10-19(18)23/h5-6,9-10,17H,3-4,7-8,11-16H2,1-2H3/q+1