methyl 3-[4-[4-(3-methoxy-3-oxidanylidene-propyl)sulfonylphenoxy]phenyl]sulfonylpropanoate

Systemtic Name: methyl 3-[4-[4-(3-methoxy-3-oxidanylidene-propyl)sulfonylphenoxy]phenyl]sulfonylpropanoate Openeye Name: methyl 3-[4-[4-(3-methoxy-3-oxo-propyl)sulfonylphenoxy]phenyl]sulfonylpropanoate CAS Name: 3-[4-[4-(3-methoxy-3-oxopropyl)sulfonylphenoxy]phenyl]sulfonylpropanoic acid methyl ester IUPAC Name: methyl 3-[4-[4-(3-methoxy-3-oxopropyl)sulfonylphenoxy]phenyl]sulfonylpropanoate Traditional Name: 3-[4-[4-(3-keto-3-methoxy-propyl)sulfonylphenoxy]phenyl]sulfonylpropionic acid methyl ester Formula: C20H22O9S2 MolecularWeight: 470.51328

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCS(=O)(=O)C1=CC=C(C=C1)OC2=CC=C(C=C2)S(=O)(=O)CCC(=O)OC

Isomeric SMILES

COC(=O)CCS(=O)(=O)C1=CC=C(C=C1)OC2=CC=C(C=C2)S(=O)(=O)CCC(=O)OC

InChI

InChI=1S/C20H22O9S2/c1-27-19(21)11-13-30(23,24)17-7-3-15(4-8-17)29-16-5-9-18(10-6-16)31(25,26)14-12-20(22)28-2/h3-10H,11-14H2,1-2H3