hexyl(dimethyl)azanium; (1-phenylcyclobutyl)benzene; bromide

Systemtic Name: hexyl(dimethyl)azanium; (1-phenylcyclobutyl)benzene; bromide Openeye Name: hexyl(dimethyl)ammonium; (1-phenylcyclobutyl)benzene; bromide CAS Name: hexyl(dimethyl)ammonium; (1-phenylcyclobutyl)benzene; bromide IUPAC Name: hexyl(dimethyl)azanium; (1-phenylcyclobutyl)benzene; bromide Traditional Name: hexyl(dimethyl)ammonium; (1-phenylcyclobutyl)benzene; bromide Formula: C24H36BrN MolecularWeight: 418.45334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[NH+](C)C.C1CC(C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

Isomeric SMILES

CCCCCC[NH+](C)C.C1CC(C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C16H16.C8H19N.BrH/c1-3-8-14(9-4-1)16(12-7-13-16)15-10-5-2-6-11-15;1-4-5-6-7-8-9(2)3;/h1-6,8-11H,7,12-13H2;4-8H2,1-3H3;1H