3-ethyl-2-oxidanyl-3-[4-(trifluoromethylsulfanyl)phenyl]-2H-naphthalene-1,4-dione

Systemtic Name: 3-ethyl-2-oxidanyl-3-[4-(trifluoromethylsulfanyl)phenyl]-2H-naphthalene-1,4-dione Openeye Name: 2-ethyl-3-hydroxy-2-[4-(trifluoromethylsulfanyl)phenyl]tetralin-1,4-dione CAS Name: 3-ethyl-2-hydroxy-3-[4-(trifluoromethylthio)phenyl]-2H-naphthalene-1,4-dione IUPAC Name: 3-ethyl-2-hydroxy-3-[4-(trifluoromethylsulfanyl)phenyl]-2H-naphthalene-1,4-dione Traditional Name: 2-ethyl-3-hydroxy-2-[4-(trifluoromethylthio)phenyl]tetralin-1,4-quinone Formula: C19H15F3O3S MolecularWeight: 380.38081

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(C(=O)C2=CC=CC=C2C1=O)O)C3=CC=C(C=C3)SC(F)(F)F

Isomeric SMILES

CCC1(C(C(=O)C2=CC=CC=C2C1=O)O)C3=CC=C(C=C3)SC(F)(F)F

InChI

InChI=1S/C19H15F3O3S/c1-2-18(11-7-9-12(10-8-11)26-19(20,21)22)16(24)14-6-4-3-5-13(14)15(23)17(18)25/h3-10,17,25H,2H2,1H3