(2,2-dimethyl-1-phenyl-henicosyl)azanium bromide

Systemtic Name: (2,2-dimethyl-1-phenyl-henicosyl)azanium bromide Openeye Name: (2,2-dimethyl-1-phenyl-henicosyl)ammonium bromide CAS Name: (2,2-dimethyl-1-phenylheneicosyl)ammonium bromide IUPAC Name: (2,2-dimethyl-1-phenylhenicosyl)azanium bromide Traditional Name: (2,2-dimethyl-1-phenyl-heneicosyl)ammonium bromide Formula: C29H54BrN MolecularWeight: 496.64976

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCC(C)(C)C(C1=CC=CC=C1)[NH3+].[Br-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCC(C)(C)C(C1=CC=CC=C1)[NH3+].[Br-]

InChI

InChI=1S/C29H53N.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-26-29(2,3)28(30)27-24-21-20-22-25-27;/h20-22,24-25,28H,4-19,23,26,30H2,1-3H3;1H