ethyl (4R)-3-methylsulfonyl-4-oxidanyl-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxylate

Systemtic Name: ethyl (4R)-3-methylsulfonyl-4-oxidanyl-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxylate Openeye Name: ethyl (4R)-4-hydroxy-3-methylsulfonyl-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxylate CAS Name: (4R)-4-hydroxy-3-methylsulfonyl-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxylic acid ethyl ester IUPAC Name: ethyl (4R)-4-hydroxy-3-methylsulfonyl-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxylate Traditional Name: (4R)-4-hydroxy-3-mesyl-4,5,6,7-tetrahydroisobenzothiophene-1-carboxylic acid ethyl ester Formula: C12H16O5S2 MolecularWeight: 304.38244

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2CCCC(C2=C(S1)S(=O)(=O)C)O

Isomeric SMILES

CCOC(=O)C1=C2CCC[C@H](C2=C(S1)S(=O)(=O)C)O

InChI

InChI=1S/C12H16O5S2/c1-3-17-11(14)10-7-5-4-6-8(13)9(7)12(18-10)19(2,15)16/h8,13H,3-6H2,1-2H3/t8-/m1/s1