trimethyl-[(2R,3S,4R)-1,3,4-tris(oxidanyl)octadecan-2-yl]azanium

Systemtic Name: trimethyl-[(2R,3S,4R)-1,3,4-tris(oxidanyl)octadecan-2-yl]azanium Openeye Name: [(1R,2S,3R)-2,3-dihydroxy-1-(hydroxymethyl)heptadecyl]-trimethyl-ammonium CAS Name: trimethyl-[(2R,3S,4R)-1,3,4-trihydroxyoctadecan-2-yl]ammonium IUPAC Name: trimethyl-[(2R,3S,4R)-1,3,4-trihydroxyoctadecan-2-yl]azanium Traditional Name: [(1R,2S,3R)-2,3-dihydroxy-1-methylol-heptadecyl]-trimethyl-ammonium Formula: C21H46NO3+ MolecularWeight: 360.59484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(C(C(CO)[N+](C)(C)C)O)O

Isomeric SMILES

CCCCCCCCCCCCCC[C@H]([C@H]([C@@H](CO)[N+](C)(C)C)O)O

InChI

InChI=1S/C21H46NO3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-20(24)21(25)19(18-23)22(2,3)4/h19-21,23-25H,5-18H2,1-4H3/q+1/t19-,20-,21+/m1/s1