[3-(2-hydroxyethyl)-1,5-bis(oxidanyl)pentan-3-yl]azanium; methyl sulfate

Systemtic Name: [3-(2-hydroxyethyl)-1,5-bis(oxidanyl)pentan-3-yl]azanium; methyl sulfate Openeye Name: [3-hydroxy-1,1-bis(2-hydroxyethyl)propyl]ammonium; methyl sulfate CAS Name: [1,5-dihydroxy-3-(2-hydroxyethyl)pentan-3-yl]ammonium; methyl sulfate IUPAC Name: [1,5-dihydroxy-3-(2-hydroxyethyl)pentan-3-yl]azanium; methyl sulfate Traditional Name: [3-hydroxy-1,1-bis(2-hydroxyethyl)propyl]ammonium; methyl sulfate Formula: C8H21NO7S MolecularWeight: 275.31984

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Descriptors Computed from Structure

Canonical SMILES:

COS(=O)(=O)[O-].C(CO)C(CCO)(CCO)[NH3+]

Isomeric SMILES

COS(=O)(=O)[O-].C(CO)C(CCO)(CCO)[NH3+]

InChI

InChI=1S/C7H17NO3.CH4O4S/c8-7(1-4-9,2-5-10)3-6-11;1-5-6(2,3)4/h9-11H,1-6,8H2;1H3,(H,2,3,4)