6-bromanyl-2-(trifluoromethyl)-6H-benzo[b][1]benzothiepin-5-one

Systemtic Name: 6-bromanyl-2-(trifluoromethyl)-6H-benzo[b][1]benzothiepin-5-one Openeye Name: 6-bromo-2-(trifluoromethyl)-6H-benzo[b][1]benzothiepin-5-one CAS Name: 6-bromo-2-(trifluoromethyl)-6H-benzo[b][1]benzothiepin-5-one IUPAC Name: 6-bromo-2-(trifluoromethyl)-6H-benzo[b][1]benzothiepin-5-one Traditional Name: 6-bromo-2-(trifluoromethyl)-6H-benzo[b][1]benzothiepin-5-one Formula: C15H8BrF3OS MolecularWeight: 373.18763

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C(=O)C3=C(S2)C=C(C=C3)C(F)(F)F)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(C(=O)C3=C(S2)C=C(C=C3)C(F)(F)F)Br

InChI

InChI=1S/C15H8BrF3OS/c16-13-9-3-1-2-4-11(9)21-12-7-8(15(17,18)19)5-6-10(12)14(13)20/h1-7,13H