[(6R)-3-chloranyl-5,6-dihydrobenzo[b][1]benzothiepin-6-yl]-dimethyl-azanium

Systemtic Name: [(6R)-3-chloranyl-5,6-dihydrobenzo[b][1]benzothiepin-6-yl]-dimethyl-azanium Openeye Name: [(6R)-3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-6-yl]-dimethyl-ammonium CAS Name: [(6R)-3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-6-yl]-dimethylammonium IUPAC Name: [(6R)-3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-6-yl]-dimethylazanium Traditional Name: [(6R)-3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-6-yl]-dimethyl-ammonium Formula: C16H17ClNS+ MolecularWeight: 290.83088

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C1CC2=C(C=CC(=C2)Cl)SC3=CC=CC=C13

Isomeric SMILES

C[NH+](C)[C@@H]1CC2=C(C=CC(=C2)Cl)SC3=CC=CC=C13

InChI

InChI=1S/C16H16ClNS/c1-18(2)14-10-11-9-12(17)7-8-15(11)19-16-6-4-3-5-13(14)16/h3-9,14H,10H2,1-2H3/p+1/t14-/m1/s1