3-[(2-hydroxyphenyl)carbonylamino]propyl-dimethyl-octadecyl-azanium bromide

Systemtic Name: 3-[(2-hydroxyphenyl)carbonylamino]propyl-dimethyl-octadecyl-azanium bromide Openeye Name: 3-[(2-hydroxybenzoyl)amino]propyl-dimethyl-octadecyl-ammonium bromide CAS Name: 3-[[(2-hydroxyphenyl)-oxomethyl]amino]propyl-dimethyl-octadecylammonium bromide IUPAC Name: 3-[(2-hydroxybenzoyl)amino]propyl-dimethyl-octadecylazanium bromide Traditional Name: dimethyl-[3-(salicyloylamino)propyl]-stearyl-ammonium bromide Formula: C30H55BrN2O2 MolecularWeight: 555.6739

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCNC(=O)C1=CC=CC=C1O.[Br-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCNC(=O)C1=CC=CC=C1O.[Br-]

InChI

InChI=1S/C30H54N2O2.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-26-32(2,3)27-22-25-31-30(34)28-23-19-20-24-29(28)33;/h19-20,23-24H,4-18,21-22,25-27H2,1-3H3,(H-,31,33,34);1H