1-(5-chloranyl-9-fluoranyl-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)ethanone

Systemtic Name: 1-(5-chloranyl-9-fluoranyl-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)ethanone Openeye Name: 1-(5-chloro-9-fluoro-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)ethanone CAS Name: 1-(5-chloro-9-fluoro-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)ethanone IUPAC Name: 1-(5-chloro-9-fluoro-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)ethanone Traditional Name: 1-(5-chloro-9-fluoro-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)ethanone Formula: C16H12ClFOS MolecularWeight: 306.782283

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)SC3=C(CC2Cl)C=CC(=C3)F

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)SC3=C(CC2Cl)C=CC(=C3)F

InChI

InChI=1S/C16H12ClFOS/c1-9(19)10-3-5-15-13(6-10)14(17)7-11-2-4-12(18)8-16(11)20-15/h2-6,8,14H,7H2,1H3