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methanesulfonate; 1-[4-(3-octadecoxypropoxy)butyl]pyridin-1-ium

methanesulfonate; 1-[4-(3-octadecoxypropoxy)butyl]pyridin-1-ium

Systemtic Name:methanesulfonate; 1-[4-(3-octadecoxypropoxy)butyl]pyridin-1-ium
Openeye Name:methanesulfonate; 1-[4-(3-octadecoxypropoxy)butyl]pyridin-1-ium
CAS Name:methanesulfonate; 1-[4-(3-octadecoxypropoxy)butyl]pyridin-1-ium
IUPAC Name:methanesulfonate; 1-[4-(3-octadecoxypropoxy)butyl]pyridin-1-ium
Traditional Name:1-[4-(3-stearyloxypropoxy)butyl]pyridin-1-ium mesylate
Formula: C31H59NO5S
MolecularWeight: 557.86886
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCCCOCCCC[N+]1=CC=CC=C1.CS(=O)(=O)[O-]


Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCCCOCCCC[N+]1=CC=CC=C1.CS(=O)(=O)[O-]


InChI

InChI=1S/C30H56NO2.CH4O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-27-32-29-23-30-33-28-22-20-26-31-24-18-17-19-25-31;1-5(2,3)4/h17-19,24-25H,2-16,20-23,26-30H2,1H3;1H3,(H,2,3,4)/q+1;/p-1


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