(2,2-dimethyl-5-methylsulfonyl-3,4-dihydrochromen-4-yl) methanesulfinate

Systemtic Name: (2,2-dimethyl-5-methylsulfonyl-3,4-dihydrochromen-4-yl) methanesulfinate Openeye Name: (2,2-dimethyl-5-methylsulfonyl-chroman-4-yl) methanesulfinate CAS Name: methanesulfinic acid (2,2-dimethyl-5-methylsulfonyl-3,4-dihydro-2H-1-benzopyran-4-yl) ester IUPAC Name: (2,2-dimethyl-5-methylsulfonyl-3,4-dihydrochromen-4-yl) methanesulfinate Traditional Name: methanesulfinic acid (5-mesyl-2,2-dimethyl-chroman-4-yl) ester Formula: C13H18O5S2 MolecularWeight: 318.40902

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C2=C(O1)C=CC=C2S(=O)(=O)C)OS(=O)C)C

Isomeric SMILES

CC1(CC(C2=C(O1)C=CC=C2S(=O)(=O)C)OS(=O)C)C

InChI

InChI=1S/C13H18O5S2/c1-13(2)8-10(18-19(3)14)12-9(17-13)6-5-7-11(12)20(4,15)16/h5-7,10H,8H2,1-4H3