3-(2-cyclohexylsulfanylethyl)-4-methyl-1,2,3-oxadiazol-3-ium-5-olate

Systemtic Name: 3-(2-cyclohexylsulfanylethyl)-4-methyl-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 3-(2-cyclohexylsulfanylethyl)-4-methyl-oxadiazol-3-ium-5-olate CAS Name: 3-[2-(cyclohexylthio)ethyl]-4-methyl-5-oxadiazol-3-iumolate IUPAC Name: 3-(2-cyclohexylsulfanylethyl)-4-methyloxadiazol-3-ium-5-olate Traditional Name: 3-[2-(cyclohexylthio)ethyl]-4-methyl-oxadiazol-3-ium-5-olate Formula: C11H18N2O2S MolecularWeight: 242.33782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(ON=[N+]1CCSC2CCCCC2)[O-]

Isomeric SMILES

CC1=C(ON=[N+]1CCSC2CCCCC2)[O-]

InChI

InChI=1S/C11H18N2O2S/c1-9-11(14)15-12-13(9)7-8-16-10-5-3-2-4-6-10/h10H,2-8H2,1H3