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

Systemtic Name: 3-ethoxy-9-fluoranyl-5,6-dihydrobenzo[b][1]benzothiepin-5-ol Openeye Name: 3-ethoxy-9-fluoro-5,6-dihydrobenzo[b][1]benzothiepin-5-ol CAS Name: 3-ethoxy-9-fluoro-5,6-dihydrobenzo[b][1]benzothiepin-5-ol IUPAC Name: 3-ethoxy-9-fluoro-5,6-dihydrobenzo[b][1]benzothiepin-5-ol Traditional Name: 3-ethoxy-9-fluoro-5,6-dihydrobenzo[b][1]benzothiepin-5-ol Formula: C16H15FO2S MolecularWeight: 290.352503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)SC3=C(CC2O)C=CC(=C3)F

Isomeric SMILES

CCOC1=CC2=C(C=C1)SC3=C(CC2O)C=CC(=C3)F

InChI

InChI=1S/C16H15FO2S/c1-2-19-12-5-6-15-13(9-12)14(18)7-10-3-4-11(17)8-16(10)20-15/h3-6,8-9,14,18H,2,7H2,1H3