2-tert-butyl-2-[4-(trifluoromethyl)phenyl]-1,3-dithiane

Systemtic Name: 2-tert-butyl-2-[4-(trifluoromethyl)phenyl]-1,3-dithiane Openeye Name: 2-tert-butyl-2-[4-(trifluoromethyl)phenyl]-1,3-dithiane CAS Name: 2-tert-butyl-2-[4-(trifluoromethyl)phenyl]-1,3-dithiane IUPAC Name: 2-tert-butyl-2-[4-(trifluoromethyl)phenyl]-1,3-dithiane Traditional Name: 2-tert-butyl-2-[4-(trifluoromethyl)phenyl]-1,3-dithiane Formula: C15H19F3S2 MolecularWeight: 320.43657

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1(SCCCS1)C2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CC(C)(C)C1(SCCCS1)C2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C15H19F3S2/c1-13(2,3)14(19-9-4-10-20-14)11-5-7-12(8-6-11)15(16,17)18/h5-8H,4,9-10H2,1-3H3