2-(2-carboxy-3,6-dimethoxy-phenyl)sulfonyl-3,6-dimethoxy-benzoic acid

Systemtic Name: 2-(2-carboxy-3,6-dimethoxy-phenyl)sulfonyl-3,6-dimethoxy-benzoic acid Openeye Name: 2-(2-carboxy-3,6-dimethoxy-phenyl)sulfonyl-3,6-dimethoxy-benzoic acid CAS Name: 2-(2-carboxy-3,6-dimethoxyphenyl)sulfonyl-3,6-dimethoxybenzoic acid IUPAC Name: 2-(2-carboxy-3,6-dimethoxyphenyl)sulfonyl-3,6-dimethoxybenzoic acid Traditional Name: 2-(2-carboxy-3,6-dimethoxy-phenyl)sulfonyl-3,6-dimethoxy-benzoic acid Formula: C18H18O10S MolecularWeight: 426.39452

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)OC)S(=O)(=O)C2=C(C=CC(=C2C(=O)O)OC)OC)C(=O)O

Isomeric SMILES

COC1=C(C(=C(C=C1)OC)S(=O)(=O)C2=C(C=CC(=C2C(=O)O)OC)OC)C(=O)O

InChI

InChI=1S/C18H18O10S/c1-25-9-5-7-11(27-3)15(13(9)17(19)20)29(23,24)16-12(28-4)8-6-10(26-2)14(16)18(21)22/h5-8H,1-4H3,(H,19,20)(H,21,22)