[4-(2-hydroxyethyl)-1,6-bis(oxidanyl)-4-sulfanyl-hexan-3-yl]azanium chloride

Systemtic Name: [4-(2-hydroxyethyl)-1,6-bis(oxidanyl)-4-sulfanyl-hexan-3-yl]azanium chloride Openeye Name: [4-hydroxy-1,2-bis(2-hydroxyethyl)-2-sulfanyl-butyl]ammonium chloride CAS Name: [1,6-dihydroxy-4-(2-hydroxyethyl)-4-mercaptohexan-3-yl]ammonium chloride IUPAC Name: [1,6-dihydroxy-4-(2-hydroxyethyl)-4-sulfanylhexan-3-yl]azanium chloride Traditional Name: [4-hydroxy-1,2-bis(2-hydroxyethyl)-2-mercapto-butyl]ammonium chloride Formula: C8H20ClNO3S MolecularWeight: 245.7673

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Descriptors Computed from Structure

Canonical SMILES:

C(CO)C(C(CCO)(CCO)S)[NH3+].[Cl-]

Isomeric SMILES

C(CO)C(C(CCO)(CCO)S)[NH3+].[Cl-]

InChI

InChI=1S/C8H19NO3S.ClH/c9-7(1-4-10)8(13,2-5-11)3-6-12;/h7,10-13H,1-6,9H2;1H