1-[3,5-bis(methoxycarbonyl)phenoxy]propane-1-sulfonic acid

Systemtic Name: 1-[3,5-bis(methoxycarbonyl)phenoxy]propane-1-sulfonic acid Openeye Name: 1-[3,5-bis(methoxycarbonyl)phenoxy]propane-1-sulfonic acid CAS Name: 1-[3,5-bis(methoxycarbonyl)phenoxy]-1-propanesulfonic acid IUPAC Name: 1-[3,5-bis(methoxycarbonyl)phenoxy]propane-1-sulfonic acid Traditional Name: 1-(3,5-dicarbomethoxyphenoxy)propane-1-sulfonic acid Formula: C13H16O8S MolecularWeight: 332.32634

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Descriptors Computed from Structure

Canonical SMILES:

CCC(OC1=CC(=CC(=C1)C(=O)OC)C(=O)OC)S(=O)(=O)O

Isomeric SMILES

CCC(OC1=CC(=CC(=C1)C(=O)OC)C(=O)OC)S(=O)(=O)O

InChI

InChI=1S/C13H16O8S/c1-4-11(22(16,17)18)21-10-6-8(12(14)19-2)5-9(7-10)13(15)20-3/h5-7,11H,4H2,1-3H3,(H,16,17,18)