3-chloranyl-9-fluoranyl-2-methoxy-5,6-dihydrobenzo[b][1]benzothiepin-5-ol

Systemtic Name: 3-chloranyl-9-fluoranyl-2-methoxy-5,6-dihydrobenzo[b][1]benzothiepin-5-ol Openeye Name: 3-chloro-9-fluoro-2-methoxy-5,6-dihydrobenzo[b][1]benzothiepin-5-ol CAS Name: 3-chloro-9-fluoro-2-methoxy-5,6-dihydrobenzo[b][1]benzothiepin-5-ol IUPAC Name: 3-chloro-9-fluoro-2-methoxy-5,6-dihydrobenzo[b][1]benzothiepin-5-ol Traditional Name: 3-chloro-9-fluoro-2-methoxy-5,6-dihydrobenzo[b][1]benzothiepin-5-ol Formula: C15H12ClFO2S MolecularWeight: 310.770983

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(CC3=C(C=C(C=C3)F)SC2=C1)O)Cl

Isomeric SMILES

COC1=C(C=C2C(CC3=C(C=C(C=C3)F)SC2=C1)O)Cl

InChI

InChI=1S/C15H12ClFO2S/c1-19-13-7-15-10(6-11(13)16)12(18)4-8-2-3-9(17)5-14(8)20-15/h2-3,5-7,12,18H,4H2,1H3