5-chloranyl-3-fluoranyl-9-methoxy-5,6-dihydrobenzo[b][1]benzothiepine

Systemtic Name: 5-chloranyl-3-fluoranyl-9-methoxy-5,6-dihydrobenzo[b][1]benzothiepine Openeye Name: 5-chloro-3-fluoro-9-methoxy-5,6-dihydrobenzo[b][1]benzothiepine CAS Name: 5-chloro-3-fluoro-9-methoxy-5,6-dihydrobenzo[b][1]benzothiepin IUPAC Name: 5-chloro-3-fluoro-9-methoxy-5,6-dihydrobenzo[b][1]benzothiepine Traditional Name: 5-chloro-3-fluoro-9-methoxy-5,6-dihydrobenzo[b][1]benzothiepin Formula: C15H12ClFOS MolecularWeight: 294.771583

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(CC(C3=C(S2)C=CC(=C3)F)Cl)C=C1

Isomeric SMILES

COC1=CC2=C(CC(C3=C(S2)C=CC(=C3)F)Cl)C=C1

InChI

InChI=1S/C15H12ClFOS/c1-18-11-4-2-9-6-13(16)12-7-10(17)3-5-14(12)19-15(9)8-11/h2-5,7-8,13H,6H2,1H3