N-[2,6-dimethyloctadecyl(propyl)amino]hexanenitrilium

Systemtic Name: N-[2,6-dimethyloctadecyl(propyl)amino]hexanenitrilium Openeye Name: N-[2,6-dimethyloctadecyl(propyl)amino]hexanenitrilium CAS Name: N-[2,6-dimethyloctadecyl(propyl)amino]hexanenitrilium IUPAC Name: N-[2,6-dimethyloctadecyl(propyl)amino]hexanenitrilium Traditional Name: N-[2,6-dimethyloctadecyl(propyl)amino]hexanenitrilium Formula: C29H59N2+ MolecularWeight: 435.79216

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C)CCCC(C)CN(CCC)[N+]#CCCCCC

Isomeric SMILES

CCCCCCCCCCCCC(C)CCCC(C)CN(CCC)[N+]#CCCCCC

InChI

InChI=1S/C29H59N2/c1-6-9-11-13-14-15-16-17-18-19-22-28(4)23-21-24-29(5)27-31(26-8-3)30-25-20-12-10-7-2/h28-29H,6-24,26-27H2,1-5H3/q+1