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

Systemtic Name: 2-[2-dodecyl-1-(phenylmethyl)-4,5-dihydroimidazole-1,3-diium-1-yl]ethanol chloride Openeye Name: 2-(1-benzyl-2-dodecyl-4,5-dihydroimidazole-1,3-diium-1-yl)ethanol chloride CAS Name: 2-[2-dodecyl-1-(phenylmethyl)-4,5-dihydroimidazole-1,3-diium-1-yl]ethanol chloride IUPAC Name: 2-(1-benzyl-2-dodecyl-4,5-dihydroimidazole-1,3-diium-1-yl)ethanol chloride Traditional Name: 2-(1-benzyl-2-lauryl-2-imidazoline-1,3-diium-1-yl)ethanol chloride Formula: C24H42ClN2O+ MolecularWeight: 410.05608

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=[NH+]CC[N+]1(CCO)CC2=CC=CC=C2.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCC1=[NH+]CC[N+]1(CCO)CC2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C24H41N2O.ClH/c1-2-3-4-5-6-7-8-9-10-14-17-24-25-18-19-26(24,20-21-27)22-23-15-12-11-13-16-23;/h11-13,15-16,27H,2-10,14,17-22H2,1H3;1H/q+1;