trimethyl-[4-[(Z)-octadec-9-enoxy]-2-oxidanyl-4-oxidanylidene-butyl]azanium iodide

Systemtic Name: trimethyl-[4-[(Z)-octadec-9-enoxy]-2-oxidanyl-4-oxidanylidene-butyl]azanium iodide Openeye Name: [2-hydroxy-4-[(Z)-octadec-9-enoxy]-4-oxo-butyl]-trimethyl-ammonium iodide CAS Name: [2-hydroxy-4-[(Z)-octadec-9-enoxy]-4-oxobutyl]-trimethylammonium iodide IUPAC Name: [2-hydroxy-4-[(Z)-octadec-9-enoxy]-4-oxobutyl]-trimethylazanium iodide Traditional Name: [2-hydroxy-4-keto-4-[(Z)-octadec-9-enoxy]butyl]-trimethyl-ammonium iodide Formula: C25H50INO3 MolecularWeight: 539.57387

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H50NO3.HI/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-29-25(28)22-24(27)23-26(2,3)4;/h12-13,24,27H,5-11,14-23H2,1-4H3;1H/q+1;/p-1/b13-12-;