2-azanyl-4,5-bis(chloranyl)-2-octyl-1-oxidanylidene-1,2-thiazol-2-ium-3-one

Systemtic Name: 2-azanyl-4,5-bis(chloranyl)-2-octyl-1-oxidanylidene-1,2-thiazol-2-ium-3-one Openeye Name: 2-amino-4,5-dichloro-2-octyl-1-oxo-isothiazol-2-ium-3-one CAS Name: 2-amino-4,5-dichloro-2-octyl-1-oxo-3-isothiazol-2-iumone IUPAC Name: 2-amino-4,5-dichloro-2-octyl-1-oxo-1,2-thiazol-2-ium-3-one Traditional Name: 2-amino-4,5-dichloro-1-keto-2-octyl-isothiazol-2-ium-3-one Formula: C11H19Cl2N2O2S+ MolecularWeight: 314.25176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[N+]1(C(=O)C(=C(S1=O)Cl)Cl)N

Isomeric SMILES

CCCCCCCC[N+]1(C(=O)C(=C(S1=O)Cl)Cl)N

InChI

InChI=1S/C11H19Cl2N2O2S/c1-2-3-4-5-6-7-8-15(14)11(16)9(12)10(13)18(15)17/h2-8,14H2,1H3/q+1