2-(chloromethyl)-1-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]benzimidazole

Systemtic Name: 2-(chloromethyl)-1-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]benzimidazole Openeye Name: 2-(chloromethyl)-1-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]benzimidazole CAS Name: 2-(chloromethyl)-1-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]benzimidazole IUPAC Name: 2-(chloromethyl)-1-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]benzimidazole Traditional Name: 2-(chloromethyl)-1-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]benzimidazole Formula: C15H21ClN3+ MolecularWeight: 278.80034

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CN2C3=CC=CC=C3N=C2CCl

Isomeric SMILES

CC[NH+]1CCC[C@H]1CN2C3=CC=CC=C3N=C2CCl

InChI

InChI=1S/C15H20ClN3/c1-2-18-9-5-6-12(18)11-19-14-8-4-3-7-13(14)17-15(19)10-16/h3-4,7-8,12H,2,5-6,9-11H2,1H3/p+1/t12-/m0/s1