(2-methyl-5-sulfo-4-sulfonatooxy-phenyl) sulfate

Systemtic Name: (2-methyl-5-sulfo-4-sulfonatooxy-phenyl) sulfate Openeye Name: (2-methyl-5-sulfo-4-sulfonatooxy-phenyl) sulfate CAS Name: (2-methyl-5-sulfo-4-sulfonatooxyphenyl) sulfate IUPAC Name: (2-methyl-5-sulfo-4-sulfonatooxyphenyl) sulfate Traditional Name: (2-methyl-4-sulfato-5-sulfo-phenyl) sulfate Formula: C7H6O11S3-2 MolecularWeight: 362.31094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1OS(=O)(=O)[O-])S(=O)(=O)O)OS(=O)(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1OS(=O)(=O)[O-])S(=O)(=O)O)OS(=O)(=O)[O-]

InChI

InChI=1S/C7H8O11S3/c1-4-2-6(18-21(14,15)16)7(19(8,9)10)3-5(4)17-20(11,12)13/h2-3H,1H3,(H,8,9,10)(H,11,12,13)(H,14,15,16)/p-2