3-(4-methoxyphenyl)sulfonyl-2-[(4-methoxyphenyl)sulfonylmethyl]propanoic acid

Systemtic Name: 3-(4-methoxyphenyl)sulfonyl-2-[(4-methoxyphenyl)sulfonylmethyl]propanoic acid Openeye Name: 3-(4-methoxyphenyl)sulfonyl-2-[(4-methoxyphenyl)sulfonylmethyl]propanoic acid CAS Name: 3-(4-methoxyphenyl)sulfonyl-2-[(4-methoxyphenyl)sulfonylmethyl]propanoic acid IUPAC Name: 3-(4-methoxyphenyl)sulfonyl-2-[(4-methoxyphenyl)sulfonylmethyl]propanoic acid Traditional Name: 3-(4-methoxyphenyl)sulfonyl-2-[(4-methoxyphenyl)sulfonylmethyl]propionic acid Formula: C18H20O8S2 MolecularWeight: 428.4766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20O8S2/c1-25-14-3-7-16(8-4-14)27(21,22)11-13(18(19)20)12-28(23,24)17-9-5-15(26-2)6-10-17/h3-10,13H,11-12H2,1-2H3,(H,19,20)