dimethyl-(2-oxidanyl-3-sulfo-propyl)-[3-(tetradecanoylamino)propyl]azanium

Systemtic Name: dimethyl-(2-oxidanyl-3-sulfo-propyl)-[3-(tetradecanoylamino)propyl]azanium Openeye Name: (2-hydroxy-3-sulfo-propyl)-dimethyl-[3-(tetradecanoylamino)propyl]ammonium CAS Name: (2-hydroxy-3-sulfopropyl)-dimethyl-[3-(1-oxotetradecylamino)propyl]ammonium IUPAC Name: (2-hydroxy-3-sulfopropyl)-dimethyl-[3-(tetradecanoylamino)propyl]azanium Traditional Name: (2-hydroxy-3-sulfo-propyl)-dimethyl-[3-(tetradecanoylamino)propyl]ammonium Formula: C22H47N2O5S+ MolecularWeight: 451.68398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC(CS(=O)(=O)O)O

Isomeric SMILES

CCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC(CS(=O)(=O)O)O

InChI

InChI=1S/C22H46N2O5S/c1-4-5-6-7-8-9-10-11-12-13-14-16-22(26)23-17-15-18-24(2,3)19-21(25)20-30(27,28)29/h21,25H,4-20H2,1-3H3,(H-,23,26,27,28,29)/p+1