3-(5-methanoyl-2,3-dimethoxy-phenoxy)propane-1-sulfonic acid

Systemtic Name: 3-(5-methanoyl-2,3-dimethoxy-phenoxy)propane-1-sulfonic acid Openeye Name: 3-(5-formyl-2,3-dimethoxy-phenoxy)propane-1-sulfonic acid CAS Name: 3-(5-formyl-2,3-dimethoxyphenoxy)-1-propanesulfonic acid IUPAC Name: 3-(5-formyl-2,3-dimethoxyphenoxy)propane-1-sulfonic acid Traditional Name: 3-(5-formyl-2,3-dimethoxy-phenoxy)propane-1-sulfonic acid Formula: C12H16O7S MolecularWeight: 304.31624

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=O)OCCCS(=O)(=O)O)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C=O)OCCCS(=O)(=O)O)OC

InChI

InChI=1S/C12H16O7S/c1-17-10-6-9(8-13)7-11(12(10)18-2)19-4-3-5-20(14,15)16/h6-8H,3-5H2,1-2H3,(H,14,15,16)