dodecanoate; 2-(methylamino)ethanesulfonate

Systemtic Name: dodecanoate; 2-(methylamino)ethanesulfonate Openeye Name: dodecanoate; 2-(methylamino)ethanesulfonate CAS Name: dodecanoate; 2-(methylamino)ethanesulfonate IUPAC Name: dodecanoate; 2-(methylamino)ethanesulfonate Traditional Name: laurate; 2-(methylamino)ethanesulfonate Formula: C15H31NO5S-2 MolecularWeight: 337.47534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)[O-].CNCCS(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCC(=O)[O-].CNCCS(=O)(=O)[O-]

InChI

InChI=1S/C12H24O2.C3H9NO3S/c1-2-3-4-5-6-7-8-9-10-11-12(13)14;1-4-2-3-8(5,6)7/h2-11H2,1H3,(H,13,14);4H,2-3H2,1H3,(H,5,6,7)/p-2