(E)-2-oxidanyl-4-phenylsulfanyl-hex-2-ene-3-diazonium

Systemtic Name: (E)-2-oxidanyl-4-phenylsulfanyl-hex-2-ene-3-diazonium Openeye Name: (E)-2-hydroxy-4-phenylsulfanyl-hex-2-ene-3-diazonium CAS Name: (E)-2-hydroxy-4-(phenylthio)-2-hexene-3-diazonium IUPAC Name: (E)-2-hydroxy-4-phenylsulfanylhex-2-ene-3-diazonium Traditional Name: (E)-2-hydroxy-4-(phenylthio)hex-2-ene-3-diazonium Formula: C12H15N2OS+ MolecularWeight: 235.3253

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=C(C)O)[N+]#N)SC1=CC=CC=C1

Isomeric SMILES

CCC(/C(=C(/C)\O)/[N+]#N)SC1=CC=CC=C1

InChI

InChI=1S/C12H14N2OS/c1-3-11(12(14-13)9(2)15)16-10-7-5-4-6-8-10/h4-8,11H,3H2,1-2H3/p+1/b12-9+