3-prop-2-enyl-6-(trifluoromethyloxy)-1,3-benzothiazol-3-ium-2-amine

Systemtic Name: 3-prop-2-enyl-6-(trifluoromethyloxy)-1,3-benzothiazol-3-ium-2-amine Openeye Name: 3-allyl-6-(trifluoromethoxy)-1,3-benzothiazol-3-ium-2-amine CAS Name: 3-prop-2-enyl-6-(trifluoromethoxy)-1,3-benzothiazol-3-ium-2-amine IUPAC Name: 3-prop-2-enyl-6-(trifluoromethoxy)-1,3-benzothiazol-3-ium-2-amine Traditional Name: [3-allyl-6-(trifluoromethoxy)-1,3-benzothiazol-3-ium-2-yl]amine Formula: C11H10F3N2OS+ MolecularWeight: 275.27011

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CC[N+]1=C(SC2=C1C=CC(=C2)OC(F)(F)F)N

Isomeric SMILES

C=CC[N+]1=C(SC2=C1C=CC(=C2)OC(F)(F)F)N

InChI

InChI=1S/C11H9F3N2OS/c1-2-5-16-8-4-3-7(17-11(12,13)14)6-9(8)18-10(16)15/h2-4,6,15H,1,5H2/p+1