3-(2,5-dimethoxyphenyl)propane-1-sulfonic acid

Systemtic Name: 3-(2,5-dimethoxyphenyl)propane-1-sulfonic acid Openeye Name: 3-(2,5-dimethoxyphenyl)propane-1-sulfonic acid CAS Name: 3-(2,5-dimethoxyphenyl)-1-propanesulfonic acid IUPAC Name: 3-(2,5-dimethoxyphenyl)propane-1-sulfonic acid Traditional Name: 3-(2,5-dimethoxyphenyl)propane-1-sulfonic acid Formula: C11H16O5S MolecularWeight: 260.30674

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16O5S/c1-15-10-5-6-11(16-2)9(8-10)4-3-7-17(12,13)14/h5-6,8H,3-4,7H2,1-2H3,(H,12,13,14)