3-[4-[2,3-bis(oxidanyl)propyl]dodecyl-dimethyl-azaniumyl]propanoate

Systemtic Name: 3-[4-[2,3-bis(oxidanyl)propyl]dodecyl-dimethyl-azaniumyl]propanoate Openeye Name: 3-[4-(2,3-dihydroxypropyl)dodecyl-dimethyl-ammonio]propanoate CAS Name: 3-[4-(2,3-dihydroxypropyl)dodecyl-dimethylammonio]propanoate IUPAC Name: 3-[4-(2,3-dihydroxypropyl)dodecyl-dimethylazaniumyl]propanoate Traditional Name: 3-[4-glyceryldodecyl(dimethyl)ammonio]propionate Formula: C20H41NO4 MolecularWeight: 359.54384

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CCC[N+](C)(C)CCC(=O)[O-])CC(CO)O

Isomeric SMILES

CCCCCCCCC(CCC[N+](C)(C)CCC(=O)[O-])CC(CO)O

InChI

InChI=1S/C20H41NO4/c1-4-5-6-7-8-9-11-18(16-19(23)17-22)12-10-14-21(2,3)15-13-20(24)25/h18-19,22-23H,4-17H2,1-3H3