2-[2-(1-oxidanylbutyl)phenoxy]ethyl-di(propan-2-yl)azanium chloride

Systemtic Name: 2-[2-(1-oxidanylbutyl)phenoxy]ethyl-di(propan-2-yl)azanium chloride Openeye Name: 2-[2-(1-hydroxybutyl)phenoxy]ethyl-diisopropyl-ammonium chloride CAS Name: 2-[2-(1-hydroxybutyl)phenoxy]ethyl-di(propan-2-yl)ammonium chloride IUPAC Name: 2-[2-(1-hydroxybutyl)phenoxy]ethyl-di(propan-2-yl)azanium chloride Traditional Name: 2-[2-(1-hydroxybutyl)phenoxy]ethyl-diisopropyl-ammonium chloride Formula: C18H32ClNO2 MolecularWeight: 329.90518

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1OCC[NH+](C(C)C)C(C)C)O.[Cl-]

Isomeric SMILES

CCCC(C1=CC=CC=C1OCC[NH+](C(C)C)C(C)C)O.[Cl-]

InChI

InChI=1S/C18H31NO2.ClH/c1-6-9-17(20)16-10-7-8-11-18(16)21-13-12-19(14(2)3)15(4)5;/h7-8,10-11,14-15,17,20H,6,9,12-13H2,1-5H3;1H