3-(2-fluoranyl-6,11-dihydrobenzo[c][1]benzothiepin-11-yl)propyl-dimethyl-azanium chloride

Systemtic Name: 3-(2-fluoranyl-6,11-dihydrobenzo[c][1]benzothiepin-11-yl)propyl-dimethyl-azanium chloride Openeye Name: 3-(2-fluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl)propyl-dimethyl-ammonium chloride CAS Name: 3-(2-fluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl)propyl-dimethylammonium chloride IUPAC Name: 3-(2-fluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl)propyl-dimethylazanium chloride Traditional Name: 3-(2-fluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-yl)propyl-dimethyl-ammonium chloride Formula: C19H23ClFNS MolecularWeight: 351.909023

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCC1C2=CC=CC=C2CSC3=C1C=C(C=C3)F.[Cl-]

Isomeric SMILES

C[NH+](C)CCCC1C2=CC=CC=C2CSC3=C1C=C(C=C3)F.[Cl-]

InChI

InChI=1S/C19H22FNS.ClH/c1-21(2)11-5-8-17-16-7-4-3-6-14(16)13-22-19-10-9-15(20)12-18(17)19;/h3-4,6-7,9-10,12,17H,5,8,11,13H2,1-2H3;1H