(E)-1-oxidanyl-1-phenyl-3-(phenylmethylsulfanyl)pent-1-ene-2-diazonium

Systemtic Name: (E)-1-oxidanyl-1-phenyl-3-(phenylmethylsulfanyl)pent-1-ene-2-diazonium Openeye Name: (E)-3-benzylsulfanyl-1-hydroxy-1-phenyl-pent-1-ene-2-diazonium CAS Name: (E)-1-hydroxy-1-phenyl-3-(phenylmethylthio)-1-pentene-2-diazonium IUPAC Name: (E)-3-benzylsulfanyl-1-hydroxy-1-phenylpent-1-ene-2-diazonium Traditional Name: (E)-3-(benzylthio)-1-hydroxy-1-phenyl-pent-1-ene-2-diazonium Formula: C18H19N2OS+ MolecularWeight: 311.42126

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=C(C1=CC=CC=C1)O)[N+]#N)SCC2=CC=CC=C2

Isomeric SMILES

CCC(/C(=C(/C1=CC=CC=C1)\O)/[N+]#N)SCC2=CC=CC=C2

InChI

InChI=1S/C18H18N2OS/c1-2-16(22-13-14-9-5-3-6-10-14)17(20-19)18(21)15-11-7-4-8-12-15/h3-12,16H,2,13H2,1H3/p+1/b18-17+