2-[(6R)-6H-benzo[b][1,5]benzoxathiepin-6-yl]ethyl-dimethyl-azanium

Systemtic Name: 2-[(6R)-6H-benzo[b][1,5]benzoxathiepin-6-yl]ethyl-dimethyl-azanium Openeye Name: 2-[(6R)-6H-benzo[b][1,5]benzoxathiepin-6-yl]ethyl-dimethyl-ammonium CAS Name: 2-[(6R)-6H-benzo[b][1,5]benzoxathiepin-6-yl]ethyl-dimethylammonium IUPAC Name: 2-[(6R)-6H-benzo[b][1,5]benzoxathiepin-6-yl]ethyl-dimethylazanium Traditional Name: 2-[(6R)-6H-benzo[b][1,5]benzoxathiepin-6-yl]ethyl-dimethyl-ammonium Formula: C17H20NOS+ MolecularWeight: 286.4118

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCC1C2=CC=CC=C2OC3=CC=CC=C3S1

Isomeric SMILES

C[NH+](C)CC[C@@H]1C2=CC=CC=C2OC3=CC=CC=C3S1

InChI

InChI=1S/C17H19NOS/c1-18(2)12-11-16-13-7-3-4-8-14(13)19-15-9-5-6-10-17(15)20-16/h3-10,16H,11-12H2,1-2H3/p+1/t16-/m1/s1