3-(octadecylamino)propane-1-sulfonic acid

Systemtic Name: 3-(octadecylamino)propane-1-sulfonic acid Openeye Name: 3-(octadecylamino)propane-1-sulfonic acid CAS Name: 3-(octadecylamino)-1-propanesulfonic acid IUPAC Name: 3-(octadecylamino)propane-1-sulfonic acid Traditional Name: 3-(stearylamino)propane-1-sulfonic acid Formula: C21H45NO3S MolecularWeight: 391.6519

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNCCCS(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNCCCS(=O)(=O)O

InChI

InChI=1S/C21H45NO3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-22-20-18-21-26(23,24)25/h22H,2-21H2,1H3,(H,23,24,25)