3-methoxy-4-sulfooxy-benzoic acid

Systemtic Name: 3-methoxy-4-sulfooxy-benzoic acid Openeye Name: 3-methoxy-4-sulfooxy-benzoic acid CAS Name: 3-methoxy-4-sulfooxybenzoic acid IUPAC Name: 3-methoxy-4-sulfooxybenzoic acid Traditional Name: 3-methoxy-4-sulfoxy-benzoic acid Formula: C8H8O7S MolecularWeight: 248.20992

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)O)OS(=O)(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)O)OS(=O)(=O)O

InChI

InChI=1S/C8H8O7S/c1-14-7-4-5(8(9)10)2-3-6(7)15-16(11,12)13/h2-4H,1H3,(H,9,10)(H,11,12,13)