[5-[2-(methylamino)-1-oxidanyl-ethyl]-2-oxidanyl-phenyl] hydrogen sulfate

Systemtic Name: [5-[2-(methylamino)-1-oxidanyl-ethyl]-2-oxidanyl-phenyl] hydrogen sulfate Openeye Name: [2-hydroxy-5-[1-hydroxy-2-(methylamino)ethyl]phenyl] hydrogen sulfate CAS Name: sulfuric acid [2-hydroxy-5-[1-hydroxy-2-(methylamino)ethyl]phenyl] ester IUPAC Name: [2-hydroxy-5-[1-hydroxy-2-(methylamino)ethyl]phenyl] hydrogen sulfate Traditional Name: sulfuric acid [2-hydroxy-5-[1-hydroxy-2-(methylamino)ethyl]phenyl] ester Formula: C9H13NO6S MolecularWeight: 263.26762

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Descriptors Computed from Structure

Canonical SMILES:

CNCC(C1=CC(=C(C=C1)O)OS(=O)(=O)O)O

Isomeric SMILES

CNCC(C1=CC(=C(C=C1)O)OS(=O)(=O)O)O

InChI

InChI=1S/C9H13NO6S/c1-10-5-8(12)6-2-3-7(11)9(4-6)16-17(13,14)15/h2-4,8,10-12H,5H2,1H3,(H,13,14,15)