(Z)-1-ethoxy-1-oxidanyl-3-(phenylmethylsulfanyl)non-1-ene-2-diazonium

Systemtic Name: (Z)-1-ethoxy-1-oxidanyl-3-(phenylmethylsulfanyl)non-1-ene-2-diazonium Openeye Name: (Z)-3-benzylsulfanyl-1-ethoxy-1-hydroxy-non-1-ene-2-diazonium CAS Name: (Z)-1-ethoxy-1-hydroxy-3-(phenylmethylthio)-1-nonene-2-diazonium IUPAC Name: (Z)-3-benzylsulfanyl-1-ethoxy-1-hydroxynon-1-ene-2-diazonium Traditional Name: (Z)-3-(benzylthio)-1-ethoxy-1-hydroxy-non-1-ene-2-diazonium Formula: C18H27N2O2S+ MolecularWeight: 335.48418

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=C(O)OCC)[N+]#N)SCC1=CC=CC=C1

Isomeric SMILES

CCCCCCC(/C(=C(\O)/OCC)/[N+]#N)SCC1=CC=CC=C1

InChI

InChI=1S/C18H26N2O2S/c1-3-5-6-10-13-16(17(20-19)18(21)22-4-2)23-14-15-11-8-7-9-12-15/h7-9,11-12,16H,3-6,10,13-14H2,1-2H3/p+1/b18-17-