sodium [18-(dimethylamino)-1-oxidanyl-1,18-bis(oxidanylidene)octadecan-9-yl] sulfate

Systemtic Name: sodium [18-(dimethylamino)-1-oxidanyl-1,18-bis(oxidanylidene)octadecan-9-yl] sulfate Openeye Name: sodium [10-(dimethylamino)-1-(8-hydroxy-8-oxo-octyl)-10-oxo-decyl] sulfate CAS Name: sodium [18-(dimethylamino)-1-hydroxy-1,18-dioxooctadecan-9-yl] sulfate IUPAC Name: sodium [18-(dimethylamino)-1-hydroxy-1,18-dioxooctadecan-9-yl] sulfate Traditional Name: sodium [10-(dimethylamino)-1-(8-hydroxy-8-keto-octyl)-10-keto-decyl] sulfate Formula: C20H38NNaO7S MolecularWeight: 459.57299

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CCCCCCCCC(CCCCCCCC(=O)O)OS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CN(C)C(=O)CCCCCCCCC(CCCCCCCC(=O)O)OS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C20H39NO7S.Na/c1-21(2)19(22)16-12-8-4-3-6-10-14-18(28-29(25,26)27)15-11-7-5-9-13-17-20(23)24;/h18H,3-17H2,1-2H3,(H,23,24)(H,25,26,27);/q;+1/p-1