[2-[8-[2-(dimethylazaniumyl)ethanoyl]dibenzothiophen-2-yl]-2-oxidanylidene-ethyl]-dimethyl-azanium dichloride

Systemtic Name: [2-[8-[2-(dimethylazaniumyl)ethanoyl]dibenzothiophen-2-yl]-2-oxidanylidene-ethyl]-dimethyl-azanium dichloride Openeye Name: [2-[8-[2-(dimethylammonio)acetyl]dibenzothiophen-2-yl]-2-oxo-ethyl]-dimethyl-ammonium dichloride CAS Name: [2-[8-[2-(dimethylammonio)-1-oxoethyl]-2-dibenzothiophenyl]-2-oxoethyl]-dimethylammonium dichloride IUPAC Name: [2-[8-[2-(dimethylazaniumyl)acetyl]dibenzothiophen-2-yl]-2-oxoethyl]-dimethylazanium dichloride Traditional Name: [2-[8-[2-(dimethylammonio)acetyl]dibenzothiophen-2-yl]-2-keto-ethyl]-dimethyl-ammonium dichloride Formula: C20H24Cl2N2O2S MolecularWeight: 427.38776

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC(=O)C1=CC2=C(C=C1)SC3=C2C=C(C=C3)C(=O)C[NH+](C)C.[Cl-].[Cl-]

Isomeric SMILES

C[NH+](C)CC(=O)C1=CC2=C(C=C1)SC3=C2C=C(C=C3)C(=O)C[NH+](C)C.[Cl-].[Cl-]

InChI

InChI=1S/C20H22N2O2S.2ClH/c1-21(2)11-17(23)13-5-7-19-15(9-13)16-10-14(6-8-20(16)25-19)18(24)12-22(3)4;;/h5-10H,11-12H2,1-4H3;2*1H