[3-(2-hydroxyethyl)-1-oxidanyl-4-prop-2-enyl-hexadecan-3-yl]azanium chloride

Systemtic Name: [3-(2-hydroxyethyl)-1-oxidanyl-4-prop-2-enyl-hexadecan-3-yl]azanium chloride Openeye Name: [2-allyl-1,1-bis(2-hydroxyethyl)tetradecyl]ammonium chloride CAS Name: [1-hydroxy-3-(2-hydroxyethyl)-4-prop-2-enylhexadecan-3-yl]ammonium chloride IUPAC Name: [1-hydroxy-3-(2-hydroxyethyl)-4-prop-2-enylhexadecan-3-yl]azanium chloride Traditional Name: [1,1-bis(2-hydroxyethyl)-2-lauryl-pent-4-enyl]ammonium chloride Formula: C21H44ClNO2 MolecularWeight: 378.03256

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CC=C)C(CCO)(CCO)[NH3+].[Cl-]

Isomeric SMILES

CCCCCCCCCCCCC(CC=C)C(CCO)(CCO)[NH3+].[Cl-]

InChI

InChI=1S/C21H43NO2.ClH/c1-3-5-6-7-8-9-10-11-12-13-15-20(14-4-2)21(22,16-18-23)17-19-24;/h4,20,23-24H,2-3,5-19,22H2,1H3;1H