[4-[dimethyl-(phenylmethyl)azaniumyl]phenyl]-tetradecylsulfonyl-azanide hydrobromide

Systemtic Name: [4-[dimethyl-(phenylmethyl)azaniumyl]phenyl]-tetradecylsulfonyl-azanide hydrobromide Openeye Name: [4-[benzyl(dimethyl)ammonio]phenyl]-tetradecylsulfonyl-azanide hydrobromide CAS Name: [4-[dimethyl-(phenylmethyl)ammonio]phenyl]-tetradecylsulfonylazanide hydrobromide IUPAC Name: [4-[benzyl(dimethyl)azaniumyl]phenyl]-tetradecylsulfonylazanide hydrobromide Traditional Name: [4-[benzyl(dimethyl)ammonio]phenyl]-myristylsulfonyl-azanide hydrobromide Formula: C29H47BrN2O2S MolecularWeight: 567.66468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCS(=O)(=O)[N-]C1=CC=C(C=C1)[N+](C)(C)CC2=CC=CC=C2.Br

Isomeric SMILES

CCCCCCCCCCCCCCS(=O)(=O)[N-]C1=CC=C(C=C1)[N+](C)(C)CC2=CC=CC=C2.Br

InChI

InChI=1S/C29H46N2O2S.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-18-25-34(32,33)30-28-21-23-29(24-22-28)31(2,3)26-27-19-16-15-17-20-27;/h15-17,19-24H,4-14,18,25-26H2,1-3H3;1H