5-(2-bromoethyl)-3-fluoranyl-5,6-dihydrobenzo[b][1]benzothiepine

Systemtic Name: 5-(2-bromoethyl)-3-fluoranyl-5,6-dihydrobenzo[b][1]benzothiepine Openeye Name: 5-(2-bromoethyl)-3-fluoro-5,6-dihydrobenzo[b][1]benzothiepine CAS Name: 5-(2-bromoethyl)-3-fluoro-5,6-dihydrobenzo[b][1]benzothiepin IUPAC Name: 5-(2-bromoethyl)-3-fluoro-5,6-dihydrobenzo[b][1]benzothiepine Traditional Name: 5-(2-bromoethyl)-3-fluoro-5,6-dihydrobenzo[b][1]benzothiepin Formula: C16H14BrFS MolecularWeight: 337.249763

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=C(C=CC(=C2)F)SC3=CC=CC=C31)CCBr

Isomeric SMILES

C1C(C2=C(C=CC(=C2)F)SC3=CC=CC=C31)CCBr

InChI

InChI=1S/C16H14BrFS/c17-8-7-11-9-12-3-1-2-4-15(12)19-16-6-5-13(18)10-14(11)16/h1-6,10-11H,7-9H2