Benzyl-Dimethyl-Octadecylazanium, 3-Nitrobenzenesulfonic Acid
[CAS# 124088-59-1]

Identification

• Name: Benzyl-Dimethyl-Octadecylazanium, 3-Nitrobenzenesulfonic Acid
• Synonyms: Benzyl-Dimethyl-Octadecyl-Ammonium; 3-Nitrobenzenesulfonic Acid; Benzyl-Dimethyl-Octadecylammonium; 3-Nitrobenzenesulfonic Acid; Benzyl-Dimethyl-Stearyl-Ammonium; 3-Nitrobenzenesulfonic Acid
• Molecular Formula: C₃₃H₅₅N₂O₅S
• Molecular Weight: 591.87
• CAS Registry Number: 124088-59-1
• SMILES: C1=C([N+]([O-])=O)C=CC=C1[S](O)(=O)=O.C2=C(C[N+](CCCCCCCCCCCCCCCCCC)(C)C)C=CC=C2
• InChI: 1S/C27H50N.C6H5NO5S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-25-28(2,3)26-27-23-20-19-21-24-27;8-7(9)5-2-1-3-6(4-5)13(10,11)12/h19-21,23-24H,4-18,22,25-26H2,1-3H3;1-4H,(H,10,11,12)/q+1
• InChIKey: BOFBUPWQQRTHQX-UHFFFAOYSA-N