1-oxidanidyl-2-[[(2S,4R)-4-phenyloxolan-2-yl]methylsulfanyl]pyridin-1-ium

Systemtic Name: 1-oxidanidyl-2-[[(2S,4R)-4-phenyloxolan-2-yl]methylsulfanyl]pyridin-1-ium Openeye Name: 1-oxido-2-[[(2S,4R)-4-phenyltetrahydrofuran-2-yl]methylsulfanyl]pyridin-1-ium CAS Name: 1-oxido-2-[[(2S,4R)-4-phenyl-2-oxolanyl]methylthio]pyridin-1-ium IUPAC Name: 1-oxido-2-[[(2S,4R)-4-phenyloxolan-2-yl]methylsulfanyl]pyridin-1-ium Traditional Name: 1-oxido-2-[[(2S,4R)-4-phenyltetrahydrofuran-2-yl]methylthio]pyridin-1-ium Formula: C16H17NO2S MolecularWeight: 287.37668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(COC1CSC2=CC=CC=[N+]2[O-])C3=CC=CC=C3

Isomeric SMILES

C1[C@@H](CO[C@@H]1CSC2=CC=CC=[N+]2[O-])C3=CC=CC=C3

InChI

InChI=1S/C16H17NO2S/c18-17-9-5-4-8-16(17)20-12-15-10-14(11-19-15)13-6-2-1-3-7-13/h1-9,14-15H,10-12H2/t14-,15-/m0/s1