ethyl 3-[4-[[4-(3-ethoxy-3-oxidanylidene-propyl)sulfonylphenyl]methyl]phenyl]sulfonylpropanoate

Systemtic Name: ethyl 3-[4-[[4-(3-ethoxy-3-oxidanylidene-propyl)sulfonylphenyl]methyl]phenyl]sulfonylpropanoate Openeye Name: ethyl 3-[4-[[4-(3-ethoxy-3-oxo-propyl)sulfonylphenyl]methyl]phenyl]sulfonylpropanoate CAS Name: 3-[4-[[4-(3-ethoxy-3-oxopropyl)sulfonylphenyl]methyl]phenyl]sulfonylpropanoic acid ethyl ester IUPAC Name: ethyl 3-[4-[[4-(3-ethoxy-3-oxopropyl)sulfonylphenyl]methyl]phenyl]sulfonylpropanoate Traditional Name: 3-[4-[4-(3-ethoxy-3-keto-propyl)sulfonylbenzyl]phenyl]sulfonylpropionic acid ethyl ester Formula: C23H28O8S2 MolecularWeight: 496.59362

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCS(=O)(=O)C1=CC=C(C=C1)CC2=CC=C(C=C2)S(=O)(=O)CCC(=O)OCC

Isomeric SMILES

CCOC(=O)CCS(=O)(=O)C1=CC=C(C=C1)CC2=CC=C(C=C2)S(=O)(=O)CCC(=O)OCC

InChI

InChI=1S/C23H28O8S2/c1-3-30-22(24)13-15-32(26,27)20-9-5-18(6-10-20)17-19-7-11-21(12-8-19)33(28,29)16-14-23(25)31-4-2/h5-12H,3-4,13-17H2,1-2H3