3-fluoranyl-9-(trifluoromethyl)-6H-benzo[b][1]benzothiepin-5-one

Systemtic Name: 3-fluoranyl-9-(trifluoromethyl)-6H-benzo[b][1]benzothiepin-5-one Openeye Name: 3-fluoro-9-(trifluoromethyl)-6H-benzo[b][1]benzothiepin-5-one CAS Name: 3-fluoro-9-(trifluoromethyl)-6H-benzo[b][1]benzothiepin-5-one IUPAC Name: 3-fluoro-9-(trifluoromethyl)-6H-benzo[b][1]benzothiepin-5-one Traditional Name: 3-fluoro-9-(trifluoromethyl)-6H-benzo[b][1]benzothiepin-5-one Formula: C15H8F4OS MolecularWeight: 312.282033

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C=C2)C(F)(F)F)SC3=C(C1=O)C=C(C=C3)F

Isomeric SMILES

C1C2=C(C=C(C=C2)C(F)(F)F)SC3=C(C1=O)C=C(C=C3)F

InChI

InChI=1S/C15H8F4OS/c16-10-3-4-13-11(7-10)12(20)5-8-1-2-9(15(17,18)19)6-14(8)21-13/h1-4,6-7H,5H2