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4-[diethyl(prop-2-enyl)azaniumyl]butan-2-yl-octadecylsulfonyl-azanide hydrobromide

4-[diethyl(prop-2-enyl)azaniumyl]butan-2-yl-octadecylsulfonyl-azanide hydrobromide

Systemtic Name:4-[diethyl(prop-2-enyl)azaniumyl]butan-2-yl-octadecylsulfonyl-azanide hydrobromide
Openeye Name:[3-[allyl(diethyl)ammonio]-1-methyl-propyl]-octadecylsulfonyl-azanide hydrobromide
CAS Name:4-[diethyl(prop-2-enyl)ammonio]butan-2-yl-octadecylsulfonylazanide hydrobromide
IUPAC Name:4-[diethyl(prop-2-enyl)azaniumyl]butan-2-yl-octadecylsulfonylazanide hydrobromide
Traditional Name:[3-[allyl(diethyl)ammonio]-1-methyl-propyl]-stearylsulfonyl-azanide hydrobromide
Formula: C29H61BrN2O2S
MolecularWeight: 581.77584
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCS(=O)(=O)[N-]C(C)CC[N+](CC)(CC)CC=C.Br


Isomeric SMILES

CCCCCCCCCCCCCCCCCCS(=O)(=O)[N-]C(C)CC[N+](CC)(CC)CC=C.Br


InChI

InChI=1S/C29H60N2O2S.BrH/c1-6-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-28-34(32,33)30-29(5)25-27-31(8-3,9-4)26-7-2;/h7,29H,2,6,8-28H2,1,3-5H3;1H


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