5-(4-nitrophenyl)pentyl-octyl-pentyl-azanium bromide

Systemtic Name: 5-(4-nitrophenyl)pentyl-octyl-pentyl-azanium bromide Openeye Name: 5-(4-nitrophenyl)pentyl-octyl-pentyl-ammonium bromide CAS Name: 5-(4-nitrophenyl)pentyl-octyl-pentylammonium bromide IUPAC Name: 5-(4-nitrophenyl)pentyl-octyl-pentylazanium bromide Traditional Name: amyl-[5-(4-nitrophenyl)pentyl]-octyl-ammonium bromide Formula: C24H43BrN2O2 MolecularWeight: 471.51442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[NH+](CCCCC)CCCCCC1=CC=C(C=C1)[N+](=O)[O-].[Br-]

Isomeric SMILES

CCCCCCCC[NH+](CCCCC)CCCCCC1=CC=C(C=C1)[N+](=O)[O-].[Br-]

InChI

InChI=1S/C24H42N2O2.BrH/c1-3-5-7-8-9-13-21-25(20-12-6-4-2)22-14-10-11-15-23-16-18-24(19-17-23)26(27)28;/h16-19H,3-15,20-22H2,1-2H3;1H