3-(3,4-dihydro-2H-chromen-7-yl)-5,5-dimethyl-4-(4-methylsulfonylphenyl)furan-2-one

Systemtic Name: 3-(3,4-dihydro-2H-chromen-7-yl)-5,5-dimethyl-4-(4-methylsulfonylphenyl)furan-2-one Openeye Name: 3-chroman-7-yl-5,5-dimethyl-4-(4-methylsulfonylphenyl)furan-2-one CAS Name: 3-(3,4-dihydro-2H-1-benzopyran-7-yl)-5,5-dimethyl-4-(4-methylsulfonylphenyl)-2-furanone IUPAC Name: 3-(3,4-dihydro-2H-chromen-7-yl)-5,5-dimethyl-4-(4-methylsulfonylphenyl)furan-2-one Traditional Name: 3-chroman-7-yl-4-(4-mesylphenyl)-5,5-dimethyl-furan-2-one Formula: C22H22O5S MolecularWeight: 398.47208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=C(C(=O)O1)C2=CC3=C(CCCO3)C=C2)C4=CC=C(C=C4)S(=O)(=O)C)C

Isomeric SMILES

CC1(C(=C(C(=O)O1)C2=CC3=C(CCCO3)C=C2)C4=CC=C(C=C4)S(=O)(=O)C)C

InChI

InChI=1S/C22H22O5S/c1-22(2)20(15-8-10-17(11-9-15)28(3,24)25)19(21(23)27-22)16-7-6-14-5-4-12-26-18(14)13-16/h6-11,13H,4-5,12H2,1-3H3