[(Z)-octadec-9-enyl]-bis(2-oxidanylpropyl)-prop-2-enyl-azanium chloride

Systemtic Name: [(Z)-octadec-9-enyl]-bis(2-oxidanylpropyl)-prop-2-enyl-azanium chloride Openeye Name: allyl-bis(2-hydroxypropyl)-[(Z)-octadec-9-enyl]ammonium chloride CAS Name: bis(2-hydroxypropyl)-[(Z)-octadec-9-enyl]-prop-2-enylammonium chloride IUPAC Name: bis(2-hydroxypropyl)-[(Z)-octadec-9-enyl]-prop-2-enylazanium chloride Traditional Name: allyl-bis(2-hydroxypropyl)-[(Z)-octadec-9-enyl]ammonium chloride Formula: C27H54ClNO2 MolecularWeight: 460.17616

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC[N+](CC=C)(CC(C)O)CC(C)O.[Cl-]

Isomeric SMILES

CCCCCCCC/C=C\CCCCCCCC[N+](CC=C)(CC(C)O)CC(C)O.[Cl-]

InChI

InChI=1S/C27H54NO2.ClH/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-28(22-6-2,24-26(3)29)25-27(4)30;/h6,13-14,26-27,29-30H,2,5,7-12,15-25H2,1,3-4H3;1H/q+1;/p-1/b14-13-;