methyl-dipentyl-(4-phenylbutyl)azanium bromide

Systemtic Name: methyl-dipentyl-(4-phenylbutyl)azanium bromide Openeye Name: methyl-dipentyl-(4-phenylbutyl)ammonium bromide CAS Name: methyl-dipentyl-(4-phenylbutyl)ammonium bromide IUPAC Name: methyl-dipentyl-(4-phenylbutyl)azanium bromide Traditional Name: diamyl-methyl-(4-phenylbutyl)ammonium bromide Formula: C21H38BrN MolecularWeight: 384.43712

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[N+](C)(CCCCC)CCCCC1=CC=CC=C1.[Br-]

Isomeric SMILES

CCCCC[N+](C)(CCCCC)CCCCC1=CC=CC=C1.[Br-]

InChI

InChI=1S/C21H38N.BrH/c1-4-6-12-18-22(3,19-13-7-5-2)20-14-11-17-21-15-9-8-10-16-21;/h8-10,15-16H,4-7,11-14,17-20H2,1-3H3;1H/q+1;/p-1