methyl 4-[2-(5-methylsulfonyl-2-phenylmethoxy-phenyl)ethyl]-2-oxidanyl-benzoate

Systemtic Name: methyl 4-[2-(5-methylsulfonyl-2-phenylmethoxy-phenyl)ethyl]-2-oxidanyl-benzoate Openeye Name: methyl 4-[2-(2-benzyloxy-5-methylsulfonyl-phenyl)ethyl]-2-hydroxy-benzoate CAS Name: 2-hydroxy-4-[2-(5-methylsulfonyl-2-phenylmethoxyphenyl)ethyl]benzoic acid methyl ester IUPAC Name: methyl 2-hydroxy-4-[2-(5-methylsulfonyl-2-phenylmethoxyphenyl)ethyl]benzoate Traditional Name: 4-[2-(2-benzoxy-5-mesyl-phenyl)ethyl]-2-hydroxy-benzoic acid methyl ester Formula: C24H24O6S MolecularWeight: 440.50876

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)CCC2=C(C=CC(=C2)S(=O)(=O)C)OCC3=CC=CC=C3)O

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)CCC2=C(C=CC(=C2)S(=O)(=O)C)OCC3=CC=CC=C3)O

InChI

InChI=1S/C24H24O6S/c1-29-24(26)21-12-9-17(14-22(21)25)8-10-19-15-20(31(2,27)28)11-13-23(19)30-16-18-6-4-3-5-7-18/h3-7,9,11-15,25H,8,10,16H2,1-2H3