2,3,3,4,5,5-hexakis-decyl-4H-imidazol-3-ium

Systemtic Name: 2,3,3,4,5,5-hexakis-decyl-4H-imidazol-3-ium Openeye Name: 2,3,3,4,5,5-hexakis-decyl-4H-imidazol-3-ium CAS Name: 2,3,3,4,5,5-hexakis-decyl-4H-imidazol-3-ium IUPAC Name: 2,3,3,4,5,5-hexakis-decyl-4H-imidazol-3-ium Traditional Name: 1,1,2,4,4,5-hexakis-decyl-2-imidazolin-1-ium Formula: C63H127N2+ MolecularWeight: 912.69588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1C(N=C([N+]1(CCCCCCCCCC)CCCCCCCCCC)CCCCCCCCCC)(CCCCCCCCCC)CCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCC1C(N=C([N+]1(CCCCCCCCCC)CCCCCCCCCC)CCCCCCCCCC)(CCCCCCCCCC)CCCCCCCCCC

InChI

InChI=1S/C63H127N2/c1-7-13-19-25-31-37-43-49-55-61-63(57-51-45-39-33-27-21-15-9-3,58-52-46-40-34-28-22-16-10-4)64-62(56-50-44-38-32-26-20-14-8-2)65(61,59-53-47-41-35-29-23-17-11-5)60-54-48-42-36-30-24-18-12-6/h61H,7-60H2,1-6H3/q+1