2-oxidanylpropyl(tripentyl)azanium chloride ethanoate

Systemtic Name: 2-oxidanylpropyl(tripentyl)azanium chloride ethanoate Openeye Name: 2-hydroxypropyl(tripentyl)ammonium acetate chloride CAS Name: 2-hydroxypropyl(tripentyl)ammonium acetate chloride IUPAC Name: 2-hydroxypropyl(tripentyl)azanium acetate chloride Traditional Name: triamyl(2-hydroxypropyl)ammonium acetate chloride Formula: C20H43ClNO3- MolecularWeight: 381.01332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H40NO.C2H4O2.ClH/c1-5-8-11-14-19(17-18(4)20,15-12-9-6-2)16-13-10-7-3;1-2(3)4;/h18,20H,5-17H2,1-4H3;1H3,(H,3,4);1H/q+1;;/p-2