[4-(hexadecylamino)phenyl]carbonyloxymethanesulfonic acid

Systemtic Name: [4-(hexadecylamino)phenyl]carbonyloxymethanesulfonic acid Openeye Name: [4-(hexadecylamino)benzoyl]oxymethanesulfonic acid CAS Name: [[4-(hexadecylamino)phenyl]-oxomethoxy]methanesulfonic acid IUPAC Name: [4-(hexadecylamino)benzoyl]oxymethanesulfonic acid Traditional Name: [4-(cetylamino)benzoyl]oxymethanesulfonic acid Formula: C24H41NO5S MolecularWeight: 455.65104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)OCS(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)OCS(=O)(=O)O

InChI

InChI=1S/C24H41NO5S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-25-23-18-16-22(17-19-23)24(26)30-21-31(27,28)29/h16-19,25H,2-15,20-21H2,1H3,(H,27,28,29)