2-hydroxyethyl-(2-methylprop-2-enyl)-[4-(octanoylamino)butyl]azanium bromide

Systemtic Name: 2-hydroxyethyl-(2-methylprop-2-enyl)-[4-(octanoylamino)butyl]azanium bromide Openeye Name: 2-hydroxyethyl-(2-methylallyl)-[4-(octanoylamino)butyl]ammonium bromide CAS Name: 2-hydroxyethyl-(2-methylprop-2-enyl)-[4-(1-oxooctylamino)butyl]ammonium bromide IUPAC Name: 2-hydroxyethyl-(2-methylprop-2-enyl)-[4-(octanoylamino)butyl]azanium bromide Traditional Name: 4-(caprylylamino)butyl-(2-hydroxyethyl)-(2-methylallyl)ammonium bromide Formula: C18H37BrN2O2 MolecularWeight: 393.40258

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NCCCC[NH+](CCO)CC(=C)C.[Br-]

Isomeric SMILES

CCCCCCCC(=O)NCCCC[NH+](CCO)CC(=C)C.[Br-]

InChI

InChI=1S/C18H36N2O2.BrH/c1-4-5-6-7-8-11-18(22)19-12-9-10-13-20(14-15-21)16-17(2)3;/h21H,2,4-16H2,1,3H3,(H,19,22);1H