tert-butyl 3-[4-[2-(4-methoxyphenyl)ethynyl]phenyl]sulfonylpropanoate

Systemtic Name: tert-butyl 3-[4-[2-(4-methoxyphenyl)ethynyl]phenyl]sulfonylpropanoate Openeye Name: tert-butyl 3-[4-[2-(4-methoxyphenyl)ethynyl]phenyl]sulfonylpropanoate CAS Name: 3-[4-[2-(4-methoxyphenyl)ethynyl]phenyl]sulfonylpropanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[4-[2-(4-methoxyphenyl)ethynyl]phenyl]sulfonylpropanoate Traditional Name: 3-[4-[2-(4-methoxyphenyl)ethynyl]phenyl]sulfonylpropionic acid tert-butyl ester Formula: C22H24O5S MolecularWeight: 400.48796

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCS(=O)(=O)C1=CC=C(C=C1)C#CC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)(C)OC(=O)CCS(=O)(=O)C1=CC=C(C=C1)C#CC2=CC=C(C=C2)OC

InChI

InChI=1S/C22H24O5S/c1-22(2,3)27-21(23)15-16-28(24,25)20-13-9-18(10-14-20)6-5-17-7-11-19(26-4)12-8-17/h7-14H,15-16H2,1-4H3