(2-methyl-3-phenoxy-pentadecan-2-yl)azanium bromide

Systemtic Name: (2-methyl-3-phenoxy-pentadecan-2-yl)azanium bromide Openeye Name: (1,1-dimethyl-2-phenoxy-tetradecyl)ammonium bromide CAS Name: (2-methyl-3-phenoxypentadecan-2-yl)ammonium bromide IUPAC Name: (2-methyl-3-phenoxypentadecan-2-yl)azanium bromide Traditional Name: (1,1-dimethyl-2-phenoxy-tetradecyl)ammonium bromide Formula: C22H40BrNO MolecularWeight: 414.4631

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C(C)(C)[NH3+])OC1=CC=CC=C1.[Br-]

Isomeric SMILES

CCCCCCCCCCCCC(C(C)(C)[NH3+])OC1=CC=CC=C1.[Br-]

InChI

InChI=1S/C22H39NO.BrH/c1-4-5-6-7-8-9-10-11-12-16-19-21(22(2,3)23)24-20-17-14-13-15-18-20;/h13-15,17-18,21H,4-12,16,19,23H2,1-3H3;1H