2-[(2R,4R)-2-methyl-6-methylsulfonyl-4-oxidanyl-2,3-dihydrochromen-4-yl]ethanoic acid

Systemtic Name: 2-[(2R,4R)-2-methyl-6-methylsulfonyl-4-oxidanyl-2,3-dihydrochromen-4-yl]ethanoic acid Openeye Name: 2-[(2R,4R)-4-hydroxy-2-methyl-6-methylsulfonyl-chroman-4-yl]acetic acid CAS Name: 2-[(2R,4R)-4-hydroxy-2-methyl-6-methylsulfonyl-3,4-dihydro-2H-1-benzopyran-4-yl]acetic acid IUPAC Name: 2-[(2R,4R)-4-hydroxy-2-methyl-6-methylsulfonyl-2,3-dihydrochromen-4-yl]acetic acid Traditional Name: 2-[(2R,4R)-4-hydroxy-6-mesyl-2-methyl-chroman-4-yl]acetic acid Formula: C13H16O6S MolecularWeight: 300.32754

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C2=C(O1)C=CC(=C2)S(=O)(=O)C)(CC(=O)O)O

Isomeric SMILES

C[C@@H]1C[C@](C2=C(O1)C=CC(=C2)S(=O)(=O)C)(CC(=O)O)O

InChI

InChI=1S/C13H16O6S/c1-8-6-13(16,7-12(14)15)10-5-9(20(2,17)18)3-4-11(10)19-8/h3-5,8,16H,6-7H2,1-2H3,(H,14,15)/t8-,13-/m1/s1