(E)-2-diazonio-1-methoxy-3-(phenylmethylsulfanyl)prop-1-en-1-olate

Systemtic Name: (E)-2-diazonio-1-methoxy-3-(phenylmethylsulfanyl)prop-1-en-1-olate Openeye Name: (E)-3-benzylsulfanyl-2-diazonio-1-methoxy-prop-1-en-1-olate CAS Name: (E)-2-diazonio-1-methoxy-3-(phenylmethylthio)-1-propen-1-olate IUPAC Name: (E)-3-benzylsulfanyl-2-diazonio-1-methoxyprop-1-en-1-olate Traditional Name: (E)-3-(benzylthio)-2-diazonio-1-methoxy-prop-1-en-1-olate Formula: C11H12N2O2S MolecularWeight: 236.29018

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Descriptors Computed from Structure

Canonical SMILES:

COC(=C(CSCC1=CC=CC=C1)[N+]#N)[O-]

Isomeric SMILES

CO/C(=C(\CSCC1=CC=CC=C1)/[N+]#N)/[O-]

InChI

InChI=1S/C11H12N2O2S/c1-15-11(14)10(13-12)8-16-7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3/b11-10+