sodium 2,4-bis(decanoylamino)benzenesulfonate

Systemtic Name: sodium 2,4-bis(decanoylamino)benzenesulfonate Openeye Name: sodium 2,4-bis(decanoylamino)benzenesulfonate CAS Name: sodium 2,4-bis(1-oxodecylamino)benzenesulfonate IUPAC Name: sodium 2,4-bis(decanoylamino)benzenesulfonate Traditional Name: sodium 2,4-bis(caprylamino)besylate Formula: C26H43N2NaO5S MolecularWeight: 518.68479

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)NC1=CC(=C(C=C1)S(=O)(=O)[O-])NC(=O)CCCCCCCCC.[Na+]

Isomeric SMILES

CCCCCCCCCC(=O)NC1=CC(=C(C=C1)S(=O)(=O)[O-])NC(=O)CCCCCCCCC.[Na+]

InChI

InChI=1S/C26H44N2O5S.Na/c1-3-5-7-9-11-13-15-17-25(29)27-22-19-20-24(34(31,32)33)23(21-22)28-26(30)18-16-14-12-10-8-6-4-2;/h19-21H,3-18H2,1-2H3,(H,27,29)(H,28,30)(H,31,32,33);/q;+1/p-1