[(2R,4R)-2-heptadecyl-1,3-dioxolan-4-yl]methyl-dimethyl-(3-oxidanylpropyl)azanium bromide

Systemtic Name: [(2R,4R)-2-heptadecyl-1,3-dioxolan-4-yl]methyl-dimethyl-(3-oxidanylpropyl)azanium bromide Openeye Name: [(2R,4R)-2-heptadecyl-1,3-dioxolan-4-yl]methyl-(3-hydroxypropyl)-dimethyl-ammonium bromide CAS Name: [(2R,4R)-2-heptadecyl-1,3-dioxolan-4-yl]methyl-(3-hydroxypropyl)-dimethylammonium bromide IUPAC Name: [(2R,4R)-2-heptadecyl-1,3-dioxolan-4-yl]methyl-(3-hydroxypropyl)-dimethylazanium bromide Traditional Name: [(2R,4R)-2-heptadecyl-1,3-dioxolan-4-yl]methyl-(3-hydroxypropyl)-dimethyl-ammonium bromide Formula: C26H54BrNO3 MolecularWeight: 508.61586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1OCC(O1)C[N+](C)(C)CCCO.[Br-]

Isomeric SMILES

CCCCCCCCCCCCCCCCC[C@@H]1OC[C@H](O1)C[N+](C)(C)CCCO.[Br-]

InChI

InChI=1S/C26H54NO3.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-26-29-24-25(30-26)23-27(2,3)21-19-22-28;/h25-26,28H,4-24H2,1-3H3;1H/q+1;/p-1/t25-,26-;/m1./s1