3-[2-[dodecyl(dimethyl)azaniumyl]ethyl-ethanoyl-amino]propane-1-sulfonate

Systemtic Name: 3-[2-[dodecyl(dimethyl)azaniumyl]ethyl-ethanoyl-amino]propane-1-sulfonate Openeye Name: 3-[acetyl-[2-[dodecyl(dimethyl)ammonio]ethyl]amino]propane-1-sulfonate CAS Name: 3-[acetyl-[2-[dodecyl(dimethyl)ammonio]ethyl]amino]-1-propanesulfonate IUPAC Name: 3-[acetyl-[2-[dodecyl(dimethyl)azaniumyl]ethyl]amino]propane-1-sulfonate Traditional Name: 3-[acetyl-[2-[lauryl(dimethyl)ammonio]ethyl]amino]propane-1-sulfonate Formula: C21H44N2O4S MolecularWeight: 420.65006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+](C)(C)CCN(CCCS(=O)(=O)[O-])C(=O)C

Isomeric SMILES

CCCCCCCCCCCC[N+](C)(C)CCN(CCCS(=O)(=O)[O-])C(=O)C

InChI

InChI=1S/C21H44N2O4S/c1-5-6-7-8-9-10-11-12-13-14-18-23(3,4)19-17-22(21(2)24)16-15-20-28(25,26)27/h5-20H2,1-4H3