2-[2-heptadecyl-3-(phenylmethyl)-4,5-dihydroimidazol-3-ium-1-yl]ethanol

Systemtic Name: 2-[2-heptadecyl-3-(phenylmethyl)-4,5-dihydroimidazol-3-ium-1-yl]ethanol Openeye Name: 2-(3-benzyl-2-heptadecyl-4,5-dihydroimidazol-3-ium-1-yl)ethanol CAS Name: 2-[2-heptadecyl-3-(phenylmethyl)-4,5-dihydroimidazol-3-ium-1-yl]ethanol IUPAC Name: 2-(3-benzyl-2-heptadecyl-4,5-dihydroimidazol-3-ium-1-yl)ethanol Traditional Name: 2-(3-benzyl-2-heptadecyl-2-imidazolin-3-ium-1-yl)ethanol Formula: C29H51N2O+ MolecularWeight: 443.72804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1=[N+](CCN1CCO)CC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1=[N+](CCN1CCO)CC2=CC=CC=C2

InChI

InChI=1S/C29H51N2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-29-30(25-26-32)23-24-31(29)27-28-20-17-16-18-21-28/h16-18,20-21,32H,2-15,19,22-27H2,1H3/q+1