hexadecyl 1-(dimethylamino)propane-1-sulfonate

Systemtic Name: hexadecyl 1-(dimethylamino)propane-1-sulfonate Openeye Name: hexadecyl 1-(dimethylamino)propane-1-sulfonate CAS Name: 1-(dimethylamino)-1-propanesulfonic acid IUPAC Name: hexadecyl 1-(dimethylamino)propane-1-sulfonate Traditional Name: 1-(dimethylamino)propane-1-sulfonic acid cetyl ester Formula: C21H45NO3S MolecularWeight: 391.6519

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOS(=O)(=O)C(CC)N(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOS(=O)(=O)C(CC)N(C)C

InChI

InChI=1S/C21H45NO3S/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25-26(23,24)21(6-2)22(3)4/h21H,5-20H2,1-4H3