2-[2-methyl-1-(phenylmethyl)-4,5-dihydroimidazole-1,3-diium-1-yl]ethanol chloride

Systemtic Name: 2-[2-methyl-1-(phenylmethyl)-4,5-dihydroimidazole-1,3-diium-1-yl]ethanol chloride Openeye Name: 2-(1-benzyl-2-methyl-4,5-dihydroimidazole-1,3-diium-1-yl)ethanol chloride CAS Name: 2-[2-methyl-1-(phenylmethyl)-4,5-dihydroimidazole-1,3-diium-1-yl]ethanol chloride IUPAC Name: 2-(1-benzyl-2-methyl-4,5-dihydroimidazole-1,3-diium-1-yl)ethanol chloride Traditional Name: 2-(1-benzyl-2-methyl-2-imidazoline-1,3-diium-1-yl)ethanol chloride Formula: C13H20ClN2O+ MolecularWeight: 255.7637

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]CC[N+]1(CCO)CC2=CC=CC=C2.[Cl-]

Isomeric SMILES

CC1=[NH+]CC[N+]1(CCO)CC2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C13H19N2O.ClH/c1-12-14-7-8-15(12,9-10-16)11-13-5-3-2-4-6-13;/h2-6,16H,7-11H2,1H3;1H/q+1;