3-(4-methoxyphenyl)-3-methyl-7-(trifluoromethyloxy)-1H-isothiochromen-4-one

Systemtic Name: 3-(4-methoxyphenyl)-3-methyl-7-(trifluoromethyloxy)-1H-isothiochromen-4-one Openeye Name: 3-(4-methoxyphenyl)-3-methyl-7-(trifluoromethoxy)isothiochroman-4-one CAS Name: 3-(4-methoxyphenyl)-3-methyl-7-(trifluoromethoxy)-1H-2-benzothiopyran-4-one IUPAC Name: 3-(4-methoxyphenyl)-3-methyl-7-(trifluoromethoxy)-1H-isothiochromen-4-one Traditional Name: 3-(4-methoxyphenyl)-3-methyl-7-(trifluoromethoxy)isothiochroman-4-one Formula: C18H15F3O3S MolecularWeight: 368.37011

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C2=C(CS1)C=C(C=C2)OC(F)(F)F)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1(C(=O)C2=C(CS1)C=C(C=C2)OC(F)(F)F)C3=CC=C(C=C3)OC

InChI

InChI=1S/C18H15F3O3S/c1-17(12-3-5-13(23-2)6-4-12)16(22)15-8-7-14(24-18(19,20)21)9-11(15)10-25-17/h3-9H,10H2,1-2H3