1-(octadecylamino)-2-oxidanyl-propane-1-sulfonic acid

Systemtic Name: 1-(octadecylamino)-2-oxidanyl-propane-1-sulfonic acid Openeye Name: 2-hydroxy-1-(octadecylamino)propane-1-sulfonic acid CAS Name: 2-hydroxy-1-(octadecylamino)-1-propanesulfonic acid IUPAC Name: 2-hydroxy-1-(octadecylamino)propane-1-sulfonic acid Traditional Name: 2-hydroxy-1-(stearylamino)propane-1-sulfonic acid Formula: C21H45NO4S MolecularWeight: 407.6513

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(C(C)O)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(C(C)O)S(=O)(=O)O

InChI

InChI=1S/C21H45NO4S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-21(20(2)23)27(24,25)26/h20-23H,3-19H2,1-2H3,(H,24,25,26)