sodium 3,9-diethyltridecan-1-ol sulfate

Systemtic Name: sodium 3,9-diethyltridecan-1-ol sulfate Openeye Name: sodium 3,9-diethyltridecan-1-ol sulfate CAS Name: sodium 3,9-diethyl-1-tridecanol sulfate IUPAC Name: sodium 3,9-diethyltridecan-1-ol sulfate Traditional Name: sodium 3,9-diethyltridecan-1-ol sulfate Formula: C17H36NaO5S- MolecularWeight: 375.51951

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CCCCCC(CC)CCO.[O-]S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCCCC(CC)CCCCCC(CC)CCO.[O-]S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C17H36O.Na.H2O4S/c1-4-7-11-16(5-2)12-9-8-10-13-17(6-3)14-15-18;;1-5(2,3)4/h16-18H,4-15H2,1-3H3;;(H2,1,2,3,4)/q;+1;/p-2