2-heptadecyl-1,3-dihexadecyl-4,5-dihydro-1H-imidazole-1,3-diium chloride

Systemtic Name: 2-heptadecyl-1,3-dihexadecyl-4,5-dihydro-1H-imidazole-1,3-diium chloride Openeye Name: 2-heptadecyl-1,3-dihexadecyl-4,5-dihydro-1H-imidazole-1,3-diium chloride CAS Name: 2-heptadecyl-1,3-dihexadecyl-4,5-dihydro-1H-imidazole-1,3-diium chloride IUPAC Name: 2-heptadecyl-1,3-dihexadecyl-4,5-dihydro-1H-imidazole-1,3-diium chloride Traditional Name: 1,3-dicetyl-2-heptadecyl-2-imidazoline-1,3-diium chloride Formula: C52H106ClN2+ MolecularWeight: 794.86444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1=[N+](CC[NH+]1CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1=[N+](CC[NH+]1CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC.[Cl-]

InChI

InChI=1S/C52H105N2.ClH/c1-4-7-10-13-16-19-22-25-28-29-32-35-38-41-44-47-52-53(48-45-42-39-36-33-30-26-23-20-17-14-11-8-5-2)50-51-54(52)49-46-43-40-37-34-31-27-24-21-18-15-12-9-6-3;/h4-51H2,1-3H3;1H/q+1;