(E)-1-methoxy-1-oxidanyl-3-(phenylmethylsulfanyl)prop-1-ene-2-diazonium

Systemtic Name: (E)-1-methoxy-1-oxidanyl-3-(phenylmethylsulfanyl)prop-1-ene-2-diazonium Openeye Name: (E)-3-benzylsulfanyl-1-hydroxy-1-methoxy-prop-1-ene-2-diazonium CAS Name: (E)-1-hydroxy-1-methoxy-3-(phenylmethylthio)-1-propene-2-diazonium IUPAC Name: (E)-3-benzylsulfanyl-1-hydroxy-1-methoxyprop-1-ene-2-diazonium Traditional Name: (E)-3-(benzylthio)-1-hydroxy-1-methoxy-prop-1-ene-2-diazonium Formula: C11H13N2O2S+ MolecularWeight: 237.29812

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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/p+1/b11-10+