(Z)-2-diazonio-1-ethoxy-3-(phenylmethylsulfanyl)non-1-en-1-olate

Systemtic Name: (Z)-2-diazonio-1-ethoxy-3-(phenylmethylsulfanyl)non-1-en-1-olate Openeye Name: (Z)-3-benzylsulfanyl-2-diazonio-1-ethoxy-non-1-en-1-olate CAS Name: (Z)-2-diazonio-1-ethoxy-3-(phenylmethylthio)-1-nonen-1-olate IUPAC Name: (Z)-3-benzylsulfanyl-2-diazonio-1-ethoxynon-1-en-1-olate Traditional Name: (Z)-3-(benzylthio)-2-diazonio-1-ethoxy-non-1-en-1-olate Formula: C18H26N2O2S MolecularWeight: 334.47624

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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/b18-17-