sodium N-[3-(2-ethanoylphenoxy)-2-oxidanyl-propyl]-N-ethyl-sulfamate

Systemtic Name: sodium N-[3-(2-ethanoylphenoxy)-2-oxidanyl-propyl]-N-ethyl-sulfamate Openeye Name: sodium N-[3-(2-acetylphenoxy)-2-hydroxy-propyl]-N-ethyl-sulfamate CAS Name: sodium N-[3-(2-acetylphenoxy)-2-hydroxypropyl]-N-ethylsulfamate IUPAC Name: sodium N-[3-(2-acetylphenoxy)-2-hydroxypropyl]-N-ethylsulfamate Traditional Name: sodium N-[3-(2-acetylphenoxy)-2-hydroxy-propyl]-N-ethyl-sulfamate Formula: C13H18NNaO6S MolecularWeight: 339.33989

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(COC1=CC=CC=C1C(=O)C)O)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCN(CC(COC1=CC=CC=C1C(=O)C)O)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C13H19NO6S.Na/c1-3-14(21(17,18)19)8-11(16)9-20-13-7-5-4-6-12(13)10(2)15;/h4-7,11,16H,3,8-9H2,1-2H3,(H,17,18,19);/q;+1/p-1