sodium [2,2-dimethyl-3-oxidanyl-4-oxidanylidene-4-[3-oxidanylidene-3-(propylamino)propyl]sulfanyl-butyl] methyl phosphate

Systemtic Name: sodium [2,2-dimethyl-3-oxidanyl-4-oxidanylidene-4-[3-oxidanylidene-3-(propylamino)propyl]sulfanyl-butyl] methyl phosphate Openeye Name: sodium [3-hydroxy-2,2-dimethyl-4-oxo-4-[3-oxo-3-(propylamino)propyl]sulfanyl-butyl] methyl phosphate CAS Name: sodium [3-hydroxy-2,2-dimethyl-4-oxo-4-[[3-oxo-3-(propylamino)propyl]thio]butyl] methyl phosphate IUPAC Name: sodium [3-hydroxy-2,2-dimethyl-4-oxo-4-[3-oxo-3-(propylamino)propyl]sulfanylbutyl] methyl phosphate Traditional Name: sodium [3-hydroxy-4-keto-4-[[3-keto-3-(propylamino)propyl]thio]-2,2-dimethyl-butyl] methyl phosphate Formula: C13H25NNaO7PS MolecularWeight: 393.368631

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CCSC(=O)C(C(C)(C)COP(=O)([O-])OC)O.[Na+]

Isomeric SMILES

CCCNC(=O)CCSC(=O)C(C(C)(C)COP(=O)([O-])OC)O.[Na+]

InChI

InChI=1S/C13H26NO7PS.Na/c1-5-7-14-10(15)6-8-23-12(17)11(16)13(2,3)9-21-22(18,19)20-4;/h11,16H,5-9H2,1-4H3,(H,14,15)(H,18,19);/q;+1/p-1