4-[2,3-bis(oxidanyl)propyl]dodecyl-(2-carboxyethyl)-dimethyl-azanium

Systemtic Name: 4-[2,3-bis(oxidanyl)propyl]dodecyl-(2-carboxyethyl)-dimethyl-azanium Openeye Name: 2-carboxyethyl-[4-(2,3-dihydroxypropyl)dodecyl]-dimethyl-ammonium CAS Name: 2-carboxyethyl-[4-(2,3-dihydroxypropyl)dodecyl]-dimethylammonium IUPAC Name: 2-carboxyethyl-[4-(2,3-dihydroxypropyl)dodecyl]-dimethylazanium Traditional Name: 2-carboxyethyl-(4-glyceryldodecyl)-dimethyl-ammonium Formula: C20H42NO4+ MolecularWeight: 360.55178

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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/p+1