6-methylsulfanyl-5-nitro-3-phenethyl-1,2,3,4-tetrahydropyridine

Systemtic Name: 6-methylsulfanyl-5-nitro-3-phenethyl-1,2,3,4-tetrahydropyridine Openeye Name: 6-methylsulfanyl-5-nitro-3-phenethyl-1,2,3,4-tetrahydropyridine CAS Name: 6-(methylthio)-5-nitro-3-phenethyl-1,2,3,4-tetrahydropyridine IUPAC Name: 6-methylsulfanyl-5-nitro-3-phenethyl-1,2,3,4-tetrahydropyridine Traditional Name: 6-(methylthio)-5-nitro-3-phenethyl-1,2,3,4-tetrahydropyridine Formula: C14H18N2O2S MolecularWeight: 278.36992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(CC(CN1)CCC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(CC(CN1)CCC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H18N2O2S/c1-19-14-13(16(17)18)9-12(10-15-14)8-7-11-5-3-2-4-6-11/h2-6,12,15H,7-10H2,1H3