2-[(2-phenyl-1,3-dioxan-5-yl)sulfanyl]-1-[4-(trifluoromethyl)phenyl]propan-1-one

Systemtic Name: 2-[(2-phenyl-1,3-dioxan-5-yl)sulfanyl]-1-[4-(trifluoromethyl)phenyl]propan-1-one Openeye Name: 2-[(2-phenyl-1,3-dioxan-5-yl)sulfanyl]-1-[4-(trifluoromethyl)phenyl]propan-1-one CAS Name: 2-[(2-phenyl-1,3-dioxan-5-yl)thio]-1-[4-(trifluoromethyl)phenyl]-1-propanone IUPAC Name: 2-[(2-phenyl-1,3-dioxan-5-yl)sulfanyl]-1-[4-(trifluoromethyl)phenyl]propan-1-one Traditional Name: 2-[(2-phenyl-1,3-dioxan-5-yl)thio]-1-[4-(trifluoromethyl)phenyl]propan-1-one Formula: C20H19F3O3S MolecularWeight: 396.42327

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)C(F)(F)F)SC2COC(OC2)C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)C1=CC=C(C=C1)C(F)(F)F)SC2COC(OC2)C3=CC=CC=C3

InChI

InChI=1S/C20H19F3O3S/c1-13(18(24)14-7-9-16(10-8-14)20(21,22)23)27-17-11-25-19(26-12-17)15-5-3-2-4-6-15/h2-10,13,17,19H,11-12H2,1H3