3-fluoranyl-5-[2-(methylamino)ethylsulfanyl]benzo[b][1]benzoxepin-8-ol

Systemtic Name: 3-fluoranyl-5-[2-(methylamino)ethylsulfanyl]benzo[b][1]benzoxepin-8-ol Openeye Name: 3-fluoro-5-[2-(methylamino)ethylsulfanyl]benzo[b][1]benzoxepin-8-ol CAS Name: 3-fluoro-5-[2-(methylamino)ethylthio]-8-benzo[b][1]benzoxepinol IUPAC Name: 3-fluoro-5-[2-(methylamino)ethylsulfanyl]benzo[b][1]benzoxepin-8-ol Traditional Name: 3-fluoro-5-[2-(methylamino)ethylthio]benzo[b][1]benzoxepin-8-ol Formula: C17H16FNO2S MolecularWeight: 317.377843

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Descriptors Computed from Structure

Canonical SMILES:

CNCCSC1=CC2=C(C=CC(=C2)O)OC3=C1C=C(C=C3)F

Isomeric SMILES

CNCCSC1=CC2=C(C=CC(=C2)O)OC3=C1C=C(C=C3)F

InChI

InChI=1S/C17H16FNO2S/c1-19-6-7-22-17-9-11-8-13(20)3-5-15(11)21-16-4-2-12(18)10-14(16)17/h2-5,8-10,19-20H,6-7H2,1H3