2-[1,1-bis(oxidanylidene)-2,3-dihydro-1,2-benzothiazol-3-yl]propyl-diethyl-methyl-azanium iodide

Systemtic Name: 2-[1,1-bis(oxidanylidene)-2,3-dihydro-1,2-benzothiazol-3-yl]propyl-diethyl-methyl-azanium iodide Openeye Name: 2-(1,1-dioxo-2,3-dihydro-1,2-benzothiazol-3-yl)propyl-diethyl-methyl-ammonium iodide CAS Name: 2-(1,1-dioxo-2,3-dihydro-1,2-benzothiazol-3-yl)propyl-diethyl-methylammonium iodide IUPAC Name: 2-(1,1-dioxo-2,3-dihydro-1,2-benzothiazol-3-yl)propyl-diethyl-methylazanium iodide Traditional Name: 2-(1,1-diketo-2,3-dihydro-1,2-benzothiazol-3-yl)propyl-diethyl-methyl-ammonium iodide Formula: C15H25IN2O2S MolecularWeight: 424.34067

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CC)CC(C)C1C2=CC=CC=C2S(=O)(=O)N1.[I-]

Isomeric SMILES

CC[N+](C)(CC)CC(C)C1C2=CC=CC=C2S(=O)(=O)N1.[I-]

InChI

InChI=1S/C15H25N2O2S.HI/c1-5-17(4,6-2)11-12(3)15-13-9-7-8-10-14(13)20(18,19)16-15;/h7-10,12,15-16H,5-6,11H2,1-4H3;1H/q+1;/p-1