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3-(2,2-diethoxy-2-methoxy-ethyl)-2-methyl-1,3-benzothiazol-3-ium iodide

3-(2,2-diethoxy-2-methoxy-ethyl)-2-methyl-1,3-benzothiazol-3-ium iodide

Systemtic Name:3-(2,2-diethoxy-2-methoxy-ethyl)-2-methyl-1,3-benzothiazol-3-ium iodide
Openeye Name:3-(2,2-diethoxy-2-methoxy-ethyl)-2-methyl-1,3-benzothiazol-3-ium iodide
CAS Name:3-(2,2-diethoxy-2-methoxyethyl)-2-methyl-1,3-benzothiazol-3-ium iodide
IUPAC Name:3-(2,2-diethoxy-2-methoxyethyl)-2-methyl-1,3-benzothiazol-3-ium iodide
Traditional Name:3-(2,2-diethoxy-2-methoxy-ethyl)-2-methyl-1,3-benzothiazol-3-ium iodide
Formula: C15H22INO3S
MolecularWeight: 423.30955
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C[N+]1=C(SC2=CC=CC=C21)C)(OC)OCC.[I-]


Isomeric SMILES

CCOC(C[N+]1=C(SC2=CC=CC=C21)C)(OC)OCC.[I-]


InChI

InChI=1S/C15H22NO3S.HI/c1-5-18-15(17-4,19-6-2)11-16-12(3)20-14-10-8-7-9-13(14)16;/h7-10H,5-6,11H2,1-4H3;1H/q+1;/p-1


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