(3-phenethyl-1,6-diphenyl-hexan-3-yl)azanium bromide

Systemtic Name: (3-phenethyl-1,6-diphenyl-hexan-3-yl)azanium bromide Openeye Name: (1,1-diphenethyl-4-phenyl-butyl)ammonium bromide CAS Name: (3-phenethyl-1,6-diphenylhexan-3-yl)ammonium bromide IUPAC Name: (3-phenethyl-1,6-diphenylhexan-3-yl)azanium bromide Traditional Name: (1,1-diphenethyl-4-phenyl-butyl)ammonium bromide Formula: C26H32BrN MolecularWeight: 438.44298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC(CCC2=CC=CC=C2)(CCC3=CC=CC=C3)[NH3+].[Br-]

Isomeric SMILES

C1=CC=C(C=C1)CCCC(CCC2=CC=CC=C2)(CCC3=CC=CC=C3)[NH3+].[Br-]

InChI

InChI=1S/C26H31N.BrH/c27-26(21-18-24-13-6-2-7-14-24,22-19-25-15-8-3-9-16-25)20-10-17-23-11-4-1-5-12-23;/h1-9,11-16H,10,17-22,27H2;1H