sodium 1-(2-fluoranylethylamino)-1-oxidanylidene-octadecane-2-sulfonate

Systemtic Name: sodium 1-(2-fluoranylethylamino)-1-oxidanylidene-octadecane-2-sulfonate Openeye Name: sodium 1-(2-fluoroethylamino)-1-oxo-octadecane-2-sulfonate CAS Name: sodium 1-(2-fluoroethylamino)-1-oxo-2-octadecanesulfonate IUPAC Name: sodium 1-(2-fluoroethylamino)-1-oxooctadecane-2-sulfonate Traditional Name: sodium 1-(2-fluoroethylamino)-1-keto-octadecane-2-sulfonate Formula: C20H39FNNaO4S MolecularWeight: 431.581133

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(C(=O)NCCF)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCCCCCCCCCCCCCCCC(C(=O)NCCF)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C20H40FNO4S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19(27(24,25)26)20(23)22-18-17-21;/h19H,2-18H2,1H3,(H,22,23)(H,24,25,26);/q;+1/p-1