sodium 4-(prop-2-enoylamino)hexadecane-1-sulfonate

Systemtic Name: sodium 4-(prop-2-enoylamino)hexadecane-1-sulfonate Openeye Name: sodium 4-(prop-2-enoylamino)hexadecane-1-sulfonate CAS Name: sodium 4-(1-oxoprop-2-enylamino)-1-hexadecanesulfonate IUPAC Name: sodium 4-(prop-2-enoylamino)hexadecane-1-sulfonate Traditional Name: sodium 4-acrylamidohexadecane-1-sulfonate Formula: C19H36NNaO4S MolecularWeight: 397.54821

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCCS(=O)(=O)[O-])NC(=O)C=C.[Na+]

Isomeric SMILES

CCCCCCCCCCCCC(CCCS(=O)(=O)[O-])NC(=O)C=C.[Na+]

InChI

InChI=1S/C19H37NO4S.Na/c1-3-5-6-7-8-9-10-11-12-13-15-18(20-19(21)4-2)16-14-17-25(22,23)24;/h4,18H,2-3,5-17H2,1H3,(H,20,21)(H,22,23,24);/q;+1/p-1