2-[2-methoxy-4-[(4-methoxyphenyl)sulfonylmethyl]phenyl]sulfonylpropanoic acid

Systemtic Name: 2-[2-methoxy-4-[(4-methoxyphenyl)sulfonylmethyl]phenyl]sulfonylpropanoic acid Openeye Name: 2-[2-methoxy-4-[(4-methoxyphenyl)sulfonylmethyl]phenyl]sulfonylpropanoic acid CAS Name: 2-[2-methoxy-4-[(4-methoxyphenyl)sulfonylmethyl]phenyl]sulfonylpropanoic acid IUPAC Name: 2-[2-methoxy-4-[(4-methoxyphenyl)sulfonylmethyl]phenyl]sulfonylpropanoic acid Traditional Name: 2-[2-methoxy-4-[(4-methoxyphenyl)sulfonylmethyl]phenyl]sulfonylpropionic acid Formula: C18H20O8S2 MolecularWeight: 428.4766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20O8S2/c1-12(18(19)20)28(23,24)17-9-4-13(10-16(17)26-3)11-27(21,22)15-7-5-14(25-2)6-8-15/h4-10,12H,11H2,1-3H3,(H,19,20)