(2-phenyl-3-sulfooxy-propyl) sulfate

Systemtic Name: (2-phenyl-3-sulfooxy-propyl) sulfate Openeye Name: (2-phenyl-3-sulfooxy-propyl) sulfate CAS Name: (2-phenyl-3-sulfooxypropyl) sulfate IUPAC Name: (2-phenyl-3-sulfooxypropyl) sulfate Traditional Name: (2-phenyl-3-sulfoxy-propyl) sulfate Formula: C9H11O8S2- MolecularWeight: 311.30884

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(COS(=O)(=O)O)COS(=O)(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(COS(=O)(=O)O)COS(=O)(=O)[O-]

InChI

InChI=1S/C9H12O8S2/c10-18(11,12)16-6-9(7-17-19(13,14)15)8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,10,11,12)(H,13,14,15)/p-1