2-(octadecylamino)propane-1-sulfonic acid

Systemtic Name: 2-(octadecylamino)propane-1-sulfonic acid Openeye Name: 2-(octadecylamino)propane-1-sulfonic acid CAS Name: 2-(octadecylamino)-1-propanesulfonic acid IUPAC Name: 2-(octadecylamino)propane-1-sulfonic acid Traditional Name: 2-(stearylamino)propane-1-sulfonic acid Formula: C21H45NO3S MolecularWeight: 391.6519

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(C)CS(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(C)CS(=O)(=O)O

InChI

InChI=1S/C21H45NO3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-21(2)20-26(23,24)25/h21-22H,3-20H2,1-2H3,(H,23,24,25)