1-[4,4-dimethyl-1,1-bis(oxidanylidene)-2,3-dihydrothiochromen-6-yl]ethanone

Systemtic Name: 1-[4,4-dimethyl-1,1-bis(oxidanylidene)-2,3-dihydrothiochromen-6-yl]ethanone Openeye Name: 1-(4,4-dimethyl-1,1-dioxo-2,3-dihydrothiochromen-6-yl)ethanone CAS Name: 1-(4,4-dimethyl-1,1-dioxo-2,3-dihydro-1-benzothiopyran-6-yl)ethanone IUPAC Name: 1-(4,4-dimethyl-1,1-dioxo-2,3-dihydrothiochromen-6-yl)ethanone Traditional Name: 1-(1,1-diketo-4,4-dimethyl-2,3-dihydrothiochromen-6-yl)ethanone Formula: C13H16O3S MolecularWeight: 252.32934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)S(=O)(=O)CCC2(C)C

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)S(=O)(=O)CCC2(C)C

InChI

InChI=1S/C13H16O3S/c1-9(14)10-4-5-12-11(8-10)13(2,3)6-7-17(12,15)16/h4-5,8H,6-7H2,1-3H3