[3-[dimethyl(prop-2-enyl)azaniumyl]-2,2-dimethyl-propyl]-undecylsulfonyl-azanide hydrobromide

Systemtic Name: [3-[dimethyl(prop-2-enyl)azaniumyl]-2,2-dimethyl-propyl]-undecylsulfonyl-azanide hydrobromide Openeye Name: [3-[allyl(dimethyl)ammonio]-2,2-dimethyl-propyl]-undecylsulfonyl-azanide hydrobromide CAS Name: [3-[dimethyl(prop-2-enyl)ammonio]-2,2-dimethylpropyl]-undecylsulfonylazanide hydrobromide IUPAC Name: [3-[dimethyl(prop-2-enyl)azaniumyl]-2,2-dimethylpropyl]-undecylsulfonylazanide hydrobromide Traditional Name: [3-[allyl(dimethyl)ammonio]-2,2-dimethyl-propyl]-undecylsulfonyl-azanide hydrobromide Formula: C21H45BrN2O2S MolecularWeight: 469.5632

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H44N2O2S.BrH/c1-7-9-10-11-12-13-14-15-16-18-26(24,25)22-19-21(3,4)20-23(5,6)17-8-2;/h8H,2,7,9-20H2,1,3-6H3;1H