hexadecyl-(4-oxidanylpentyl)-bis(3-oxidanylpropyl)azanium

Systemtic Name: hexadecyl-(4-oxidanylpentyl)-bis(3-oxidanylpropyl)azanium Openeye Name: hexadecyl-(4-hydroxypentyl)-bis(3-hydroxypropyl)ammonium CAS Name: hexadecyl-(4-hydroxypentyl)-bis(3-hydroxypropyl)ammonium IUPAC Name: hexadecyl-(4-hydroxypentyl)-bis(3-hydroxypropyl)azanium Traditional Name: cetyl-(4-hydroxypentyl)-bis(3-hydroxypropyl)ammonium Formula: C27H58NO3+ MolecularWeight: 444.75432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](CCCC(C)O)(CCCO)CCCO

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](CCCC(C)O)(CCCO)CCCO

InChI

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