3-ethyl-9-fluoranyl-5,6-dihydrobenzo[b][1]benzothiepin-5-ol

Systemtic Name: 3-ethyl-9-fluoranyl-5,6-dihydrobenzo[b][1]benzothiepin-5-ol Openeye Name: 3-ethyl-9-fluoro-5,6-dihydrobenzo[b][1]benzothiepin-5-ol CAS Name: 3-ethyl-9-fluoro-5,6-dihydrobenzo[b][1]benzothiepin-5-ol IUPAC Name: 3-ethyl-9-fluoro-5,6-dihydrobenzo[b][1]benzothiepin-5-ol Traditional Name: 3-ethyl-9-fluoro-5,6-dihydrobenzo[b][1]benzothiepin-5-ol Formula: C16H15FOS MolecularWeight: 274.353103

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)SC3=C(CC2O)C=CC(=C3)F

Isomeric SMILES

CCC1=CC2=C(C=C1)SC3=C(CC2O)C=CC(=C3)F

InChI

InChI=1S/C16H15FOS/c1-2-10-3-6-15-13(7-10)14(18)8-11-4-5-12(17)9-16(11)19-15/h3-7,9,14,18H,2,8H2,1H3