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methyl-[3-methyl-6-(trifluoromethyloxy)-1,3-benzothiazol-2-ylidene]-prop-2-ynyl-azanium

methyl-[3-methyl-6-(trifluoromethyloxy)-1,3-benzothiazol-2-ylidene]-prop-2-ynyl-azanium

Systemtic Name:methyl-[3-methyl-6-(trifluoromethyloxy)-1,3-benzothiazol-2-ylidene]-prop-2-ynyl-azanium
Openeye Name:methyl-[3-methyl-6-(trifluoromethoxy)-1,3-benzothiazol-2-ylidene]-prop-2-ynyl-ammonium
CAS Name:methyl-[3-methyl-6-(trifluoromethoxy)-1,3-benzothiazol-2-ylidene]-prop-2-ynylammonium
IUPAC Name:methyl-[3-methyl-6-(trifluoromethoxy)-1,3-benzothiazol-2-ylidene]-prop-2-ynylazanium
Traditional Name:methyl-[3-methyl-6-(trifluoromethoxy)-1,3-benzothiazol-2-ylidene]-propargyl-ammonium
Formula: C13H12F3N2OS+
MolecularWeight: 301.30739
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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)OC(F)(F)F)SC1=[N+](C)CC#C


Isomeric SMILES

CN1C2=C(C=C(C=C2)OC(F)(F)F)SC1=[N+](C)CC#C


InChI

InChI=1S/C13H12F3N2OS/c1-4-7-17(2)12-18(3)10-6-5-9(8-11(10)20-12)19-13(14,15)16/h1,5-6,8H,7H2,2-3H3/q+1


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