2-[[4-[2-(4-methylsulfonyloxyphenyl)ethoxy]phenyl]methylidene]propanedioic acid

Systemtic Name: 2-[[4-[2-(4-methylsulfonyloxyphenyl)ethoxy]phenyl]methylidene]propanedioic acid Openeye Name: 2-[[4-[2-(4-methylsulfonyloxyphenyl)ethoxy]phenyl]methylene]propanedioic acid CAS Name: 2-[[4-[2-(4-methylsulfonyloxyphenyl)ethoxy]phenyl]methylidene]propanedioic acid IUPAC Name: 2-[[4-[2-(4-methylsulfonyloxyphenyl)ethoxy]phenyl]methylidene]propanedioic acid Traditional Name: 2-[4-[2-(4-methylsulfonyloxyphenyl)ethoxy]benzylidene]malonic acid Formula: C19H18O8S MolecularWeight: 406.40642

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=CC=C(C=C1)CCOC2=CC=C(C=C2)C=C(C(=O)O)C(=O)O

Isomeric SMILES

CS(=O)(=O)OC1=CC=C(C=C1)CCOC2=CC=C(C=C2)C=C(C(=O)O)C(=O)O

InChI

InChI=1S/C19H18O8S/c1-28(24,25)27-16-8-2-13(3-9-16)10-11-26-15-6-4-14(5-7-15)12-17(18(20)21)19(22)23/h2-9,12H,10-11H2,1H3,(H,20,21)(H,22,23)