[(1R)-2-ethoxy-2-oxidanylidene-1-phenyl-ethyl] 4-[(phenylmethyl)sulfonylmethyl]benzoate

Systemtic Name: [(1R)-2-ethoxy-2-oxidanylidene-1-phenyl-ethyl] 4-[(phenylmethyl)sulfonylmethyl]benzoate Openeye Name: [(1R)-2-ethoxy-2-oxo-1-phenyl-ethyl] 4-(benzylsulfonylmethyl)benzoate CAS Name: 4-[(phenylmethyl)sulfonylmethyl]benzoic acid [(1R)-2-ethoxy-2-oxo-1-phenylethyl] ester IUPAC Name: [(1R)-2-ethoxy-2-oxo-1-phenylethyl] 4-(benzylsulfonylmethyl)benzoate Traditional Name: 4-(benzylsulfonylmethyl)benzoic acid [(1R)-2-ethoxy-2-keto-1-phenyl-ethyl] ester Formula: C25H24O6S MolecularWeight: 452.51946

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)CS(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@@H](C1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)CS(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C25H24O6S/c1-2-30-25(27)23(21-11-7-4-8-12-21)31-24(26)22-15-13-20(14-16-22)18-32(28,29)17-19-9-5-3-6-10-19/h3-16,23H,2,17-18H2,1H3/t23-/m1/s1