(2S,3S)-3-(4-methylsulfonylphenyl)-4-oxidanyl-2-phenyl-butanoic acid

Systemtic Name: (2S,3S)-3-(4-methylsulfonylphenyl)-4-oxidanyl-2-phenyl-butanoic acid Openeye Name: (2S,3S)-4-hydroxy-3-(4-methylsulfonylphenyl)-2-phenyl-butanoic acid CAS Name: (2S,3S)-4-hydroxy-3-(4-methylsulfonylphenyl)-2-phenylbutanoic acid IUPAC Name: (2S,3S)-4-hydroxy-3-(4-methylsulfonylphenyl)-2-phenylbutanoic acid Traditional Name: (2S,3S)-4-hydroxy-3-(4-mesylphenyl)-2-phenyl-butyric acid Formula: C17H18O5S MolecularWeight: 334.38682

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(CO)C(C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)[C@@H](CO)[C@@H](C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C17H18O5S/c1-23(21,22)14-9-7-12(8-10-14)15(11-18)16(17(19)20)13-5-3-2-4-6-13/h2-10,15-16,18H,11H2,1H3,(H,19,20)/t15-,16-/m1/s1