[3-(2-hexan-2-yldecanoyloxy)-2-oxidanyl-propyl]-trimethyl-azanium

Systemtic Name: [3-(2-hexan-2-yldecanoyloxy)-2-oxidanyl-propyl]-trimethyl-azanium Openeye Name: [2-hydroxy-3-[2-(1-methylpentyl)decanoyloxy]propyl]-trimethyl-ammonium CAS Name: [3-(2-hexan-2-yl-1-oxodecoxy)-2-hydroxypropyl]-trimethylammonium IUPAC Name: [3-(2-hexan-2-yldecanoyloxy)-2-hydroxypropyl]-trimethylazanium Traditional Name: [2-hydroxy-3-[2-(1-methylpentyl)decanoyloxy]propyl]-trimethyl-ammonium Formula: C22H46NO3+ MolecularWeight: 372.60554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C(C)CCCC)C(=O)OCC(C[N+](C)(C)C)O

Isomeric SMILES

CCCCCCCCC(C(C)CCCC)C(=O)OCC(C[N+](C)(C)C)O

InChI

InChI=1S/C22H46NO3/c1-7-9-11-12-13-14-16-21(19(3)15-10-8-2)22(25)26-18-20(24)17-23(4,5)6/h19-21,24H,7-18H2,1-6H3/q+1