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

Systemtic Name: [3-[dimethyl-(phenylmethyl)azaniumyl]-2,2-dimethyl-propyl]-undecylsulfonyl-azanide hydrobromide Openeye Name: [3-[benzyl(dimethyl)ammonio]-2,2-dimethyl-propyl]-undecylsulfonyl-azanide hydrobromide CAS Name: [3-[dimethyl-(phenylmethyl)ammonio]-2,2-dimethylpropyl]-undecylsulfonylazanide hydrobromide IUPAC Name: [3-[benzyl(dimethyl)azaniumyl]-2,2-dimethylpropyl]-undecylsulfonylazanide hydrobromide Traditional Name: [3-[benzyl(dimethyl)ammonio]-2,2-dimethyl-propyl]-undecylsulfonyl-azanide hydrobromide Formula: C25H47BrN2O2S MolecularWeight: 519.62188

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCS(=O)(=O)[N-]CC(C)(C)C[N+](C)(C)CC1=CC=CC=C1.Br

Isomeric SMILES

CCCCCCCCCCCS(=O)(=O)[N-]CC(C)(C)C[N+](C)(C)CC1=CC=CC=C1.Br

InChI

InChI=1S/C25H46N2O2S.BrH/c1-6-7-8-9-10-11-12-13-17-20-30(28,29)26-22-25(2,3)23-27(4,5)21-24-18-15-14-16-19-24;/h14-16,18-19H,6-13,17,20-23H2,1-5H3;1H