1-(3-nitrophenyl)-2-(2,3,4,5-tetrahydropyridin-6-ylsulfanyl)ethanone hydrobromide

Systemtic Name: 1-(3-nitrophenyl)-2-(2,3,4,5-tetrahydropyridin-6-ylsulfanyl)ethanone hydrobromide Openeye Name: 1-(3-nitrophenyl)-2-(2,3,4,5-tetrahydropyridin-6-ylsulfanyl)ethanone hydrobromide CAS Name: 1-(3-nitrophenyl)-2-(2,3,4,5-tetrahydropyridin-6-ylthio)ethanone hydrobromide IUPAC Name: 1-(3-nitrophenyl)-2-(2,3,4,5-tetrahydropyridin-6-ylsulfanyl)ethanone hydrobromide Traditional Name: 1-(3-nitrophenyl)-2-(2,3,4,5-tetrahydropyridin-6-ylthio)ethanone hydrobromide Formula: C13H15BrN2O3S MolecularWeight: 359.2388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN=C(C1)SCC(=O)C2=CC(=CC=C2)[N+](=O)[O-].Br

Isomeric SMILES

C1CCN=C(C1)SCC(=O)C2=CC(=CC=C2)[N+](=O)[O-].Br

InChI

InChI=1S/C13H14N2O3S.BrH/c16-12(9-19-13-6-1-2-7-14-13)10-4-3-5-11(8-10)15(17)18;/h3-5,8H,1-2,6-7,9H2;1H