dimethyl-octan-2-yl-(4-phenylbutyl)azanium bromide

Systemtic Name: dimethyl-octan-2-yl-(4-phenylbutyl)azanium bromide Openeye Name: dimethyl-(1-methylheptyl)-(4-phenylbutyl)ammonium bromide CAS Name: dimethyl-octan-2-yl-(4-phenylbutyl)ammonium bromide IUPAC Name: dimethyl-octan-2-yl-(4-phenylbutyl)azanium bromide Traditional Name: dimethyl-(1-methylheptyl)-(4-phenylbutyl)ammonium bromide Formula: C20H36BrN MolecularWeight: 370.41054

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H36N.BrH/c1-5-6-7-9-14-19(2)21(3,4)18-13-12-17-20-15-10-8-11-16-20;/h8,10-11,15-16,19H,5-7,9,12-14,17-18H2,1-4H3;1H/q+1;/p-1