1-(3-methylsulfonyl-5-oxidanyl-3,4-dihydro-2H-chromen-6-yl)ethanone

Systemtic Name: 1-(3-methylsulfonyl-5-oxidanyl-3,4-dihydro-2H-chromen-6-yl)ethanone Openeye Name: 1-(5-hydroxy-3-methylsulfonyl-chroman-6-yl)ethanone CAS Name: 1-(5-hydroxy-3-methylsulfonyl-3,4-dihydro-2H-1-benzopyran-6-yl)ethanone IUPAC Name: 1-(5-hydroxy-3-methylsulfonyl-3,4-dihydro-2H-chromen-6-yl)ethanone Traditional Name: 1-(5-hydroxy-3-mesyl-chroman-6-yl)ethanone Formula: C12H14O5S MolecularWeight: 270.30156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C2=C(C=C1)OCC(C2)S(=O)(=O)C)O

Isomeric SMILES

CC(=O)C1=C(C2=C(C=C1)OCC(C2)S(=O)(=O)C)O

InChI

InChI=1S/C12H14O5S/c1-7(13)9-3-4-11-10(12(9)14)5-8(6-17-11)18(2,15)16/h3-4,8,14H,5-6H2,1-2H3