3-(2-piperidin-1-ylethyl)-6-(trifluoromethyloxy)-1,3-benzothiazol-3-ium-2-amine

Systemtic Name: 3-(2-piperidin-1-ylethyl)-6-(trifluoromethyloxy)-1,3-benzothiazol-3-ium-2-amine Openeye Name: 3-[2-(1-piperidyl)ethyl]-6-(trifluoromethoxy)-1,3-benzothiazol-3-ium-2-amine CAS Name: 3-[2-(1-piperidinyl)ethyl]-6-(trifluoromethoxy)-1,3-benzothiazol-3-ium-2-amine IUPAC Name: 3-(2-piperidin-1-ylethyl)-6-(trifluoromethoxy)-1,3-benzothiazol-3-ium-2-amine Traditional Name: [3-(2-piperidinoethyl)-6-(trifluoromethoxy)-1,3-benzothiazol-3-ium-2-yl]amine Formula: C15H19F3N3OS+ MolecularWeight: 346.39107

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC[N+]2=C(SC3=C2C=CC(=C3)OC(F)(F)F)N

Isomeric SMILES

C1CCN(CC1)CC[N+]2=C(SC3=C2C=CC(=C3)OC(F)(F)F)N

InChI

InChI=1S/C15H18F3N3OS/c16-15(17,18)22-11-4-5-12-13(10-11)23-14(19)21(12)9-8-20-6-2-1-3-7-20/h4-5,10,19H,1-3,6-9H2/p+1