[3-(3-chloranyl-2-oxidanyl-propyl)-2-methyl-tridecan-2-yl]azanium bromide

Systemtic Name: [3-(3-chloranyl-2-oxidanyl-propyl)-2-methyl-tridecan-2-yl]azanium bromide Openeye Name: [2-(3-chloro-2-hydroxy-propyl)-1,1-dimethyl-dodecyl]ammonium bromide CAS Name: [3-(3-chloro-2-hydroxypropyl)-2-methyltridecan-2-yl]ammonium bromide IUPAC Name: [3-(3-chloro-2-hydroxypropyl)-2-methyltridecan-2-yl]azanium bromide Traditional Name: [2-(3-chloro-2-hydroxy-propyl)-1,1-dimethyl-dodecyl]ammonium bromide Formula: C17H37BrClNO MolecularWeight: 386.83878

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(CC(CCl)O)C(C)(C)[NH3+].[Br-]

Isomeric SMILES

CCCCCCCCCCC(CC(CCl)O)C(C)(C)[NH3+].[Br-]

InChI

InChI=1S/C17H36ClNO.BrH/c1-4-5-6-7-8-9-10-11-12-15(17(2,3)19)13-16(20)14-18;/h15-16,20H,4-14,19H2,1-3H3;1H