hexadecyl-(2-oxidanylpentyl)-bis(3-oxidanylpropyl)azanium

Systemtic Name: hexadecyl-(2-oxidanylpentyl)-bis(3-oxidanylpropyl)azanium Openeye Name: hexadecyl-(2-hydroxypentyl)-bis(3-hydroxypropyl)ammonium CAS Name: hexadecyl-(2-hydroxypentyl)-bis(3-hydroxypropyl)ammonium IUPAC Name: hexadecyl-(2-hydroxypentyl)-bis(3-hydroxypropyl)azanium Traditional Name: cetyl-(2-hydroxypentyl)-bis(3-hydroxypropyl)ammonium Formula: C27H58NO3+ MolecularWeight: 444.75432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](CCCO)(CCCO)CC(CCC)O

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](CCCO)(CCCO)CC(CCC)O

InChI

InChI=1S/C27H58NO3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-21-28(22-18-24-29,23-19-25-30)26-27(31)20-4-2/h27,29-31H,3-26H2,1-2H3/q+1