2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate; tributyl(methyl)azanium

Systemtic Name: 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate; tributyl(methyl)azanium Openeye Name: 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate; tributyl(methyl)ammonium CAS Name: 2-methyl-2-(1-oxoprop-2-enylamino)-1-propanesulfonate; tributyl(methyl)ammonium IUPAC Name: 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate; tributyl(methyl)azanium Traditional Name: 2-acrylamido-2-methyl-propane-1-sulfonate; tributyl(methyl)ammonium Formula: C20H42N2O4S MolecularWeight: 406.62348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](C)(CCCC)CCCC.CC(C)(CS(=O)(=O)[O-])NC(=O)C=C

Isomeric SMILES

CCCC[N+](C)(CCCC)CCCC.CC(C)(CS(=O)(=O)[O-])NC(=O)C=C

InChI

InChI=1S/C13H30N.C7H13NO4S/c1-5-8-11-14(4,12-9-6-2)13-10-7-3;1-4-6(9)8-7(2,3)5-13(10,11)12/h5-13H2,1-4H3;4H,1,5H2,2-3H3,(H,8,9)(H,10,11,12)/q+1;/p-1