[(2R)-4-dodecoxy-2-(3-methylbutanoyloxy)-4-oxidanylidene-butyl]-trimethyl-azanium chloride

Systemtic Name: [(2R)-4-dodecoxy-2-(3-methylbutanoyloxy)-4-oxidanylidene-butyl]-trimethyl-azanium chloride Openeye Name: [(2R)-4-dodecoxy-2-(3-methylbutanoyloxy)-4-oxo-butyl]-trimethyl-ammonium chloride CAS Name: [(2R)-4-dodecoxy-2-(3-methyl-1-oxobutoxy)-4-oxobutyl]-trimethylammonium chloride IUPAC Name: [(2R)-4-dodecoxy-2-(3-methylbutanoyloxy)-4-oxobutyl]-trimethylazanium chloride Traditional Name: [(2R)-2-isovaleryloxy-4-keto-4-lauryloxy-butyl]-trimethyl-ammonium chloride Formula: C24H48ClNO4 MolecularWeight: 450.09522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C[C@H](C[N+](C)(C)C)OC(=O)CC(C)C.[Cl-]

InChI

InChI=1S/C24H48NO4.ClH/c1-7-8-9-10-11-12-13-14-15-16-17-28-23(26)19-22(20-25(4,5)6)29-24(27)18-21(2)3;/h21-22H,7-20H2,1-6H3;1H/q+1;/p-1/t22-;/m1./s1