3-[4-[2-(4-methoxyphenyl)ethynyl]phenyl]sulfonylpropanoic acid

Systemtic Name: 3-[4-[2-(4-methoxyphenyl)ethynyl]phenyl]sulfonylpropanoic acid Openeye Name: 3-[4-[2-(4-methoxyphenyl)ethynyl]phenyl]sulfonylpropanoic acid CAS Name: 3-[4-[2-(4-methoxyphenyl)ethynyl]phenyl]sulfonylpropanoic acid IUPAC Name: 3-[4-[2-(4-methoxyphenyl)ethynyl]phenyl]sulfonylpropanoic acid Traditional Name: 3-[4-[2-(4-methoxyphenyl)ethynyl]phenyl]sulfonylpropionic acid Formula: C18H16O5S MolecularWeight: 344.38164

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C#CC2=CC=C(C=C2)S(=O)(=O)CCC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C#CC2=CC=C(C=C2)S(=O)(=O)CCC(=O)O

InChI

InChI=1S/C18H16O5S/c1-23-16-8-4-14(5-9-16)2-3-15-6-10-17(11-7-15)24(21,22)13-12-18(19)20/h4-11H,12-13H2,1H3,(H,19,20)