[(3E)-3-(9-fluoranyl-6H-benzo[c][1]benzothiepin-11-ylidene)propyl]-dimethyl-azanium

Systemtic Name: [(3E)-3-(9-fluoranyl-6H-benzo[c][1]benzothiepin-11-ylidene)propyl]-dimethyl-azanium Openeye Name: [(3E)-3-(9-fluoro-6H-benzo[c][1]benzothiepin-11-ylidene)propyl]-dimethyl-ammonium CAS Name: [(3E)-3-(9-fluoro-6H-benzo[c][1]benzothiepin-11-ylidene)propyl]-dimethylammonium IUPAC Name: [(3E)-3-(9-fluoro-6H-benzo[c][1]benzothiepin-11-ylidene)propyl]-dimethylazanium Traditional Name: [(3E)-3-(9-fluoro-6H-benzo[c][1]benzothiepin-11-ylidene)propyl]-dimethyl-ammonium Formula: C19H21FNS+ MolecularWeight: 314.440143

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCC=C1C2=CC=CC=C2SCC3=C1C=C(C=C3)F

Isomeric SMILES

C[NH+](C)CC/C=C\1/C2=CC=CC=C2SCC3=C1C=C(C=C3)F

InChI

InChI=1S/C19H20FNS/c1-21(2)11-5-7-16-17-6-3-4-8-19(17)22-13-14-9-10-15(20)12-18(14)16/h3-4,6-10,12H,5,11,13H2,1-2H3/p+1/b16-7-