sodium 1-oxidanyl-2-phenyl-ethanesulfonate

Systemtic Name: sodium 1-oxidanyl-2-phenyl-ethanesulfonate Openeye Name: sodium 1-hydroxy-2-phenyl-ethanesulfonate CAS Name: sodium 1-hydroxy-2-phenylethanesulfonate IUPAC Name: sodium 1-hydroxy-2-phenylethanesulfonate Traditional Name: sodium 1-hydroxy-2-phenyl-ethanesulfonate Formula: C8H9NaO4S MolecularWeight: 224.20943

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(O)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)CC(O)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C8H10O4S.Na/c9-8(13(10,11)12)6-7-4-2-1-3-5-7;/h1-5,8-9H,6H2,(H,10,11,12);/q;+1/p-1