(Z)-4-diazonio-1-(4-methoxysulfonylphenyl)-5-oxidanylidene-hex-3-en-3-olate

Systemtic Name: (Z)-4-diazonio-1-(4-methoxysulfonylphenyl)-5-oxidanylidene-hex-3-en-3-olate Openeye Name: (Z)-4-diazonio-1-(4-methoxysulfonylphenyl)-5-oxo-hex-3-en-3-olate CAS Name: (Z)-4-diazonio-1-(4-methoxysulfonylphenyl)-5-oxo-3-hexen-3-olate IUPAC Name: (Z)-4-diazonio-1-(4-methoxysulfonylphenyl)-5-oxohex-3-en-3-olate Traditional Name: (Z)-4-diazonio-5-keto-1-(4-methoxysulfonylphenyl)hex-3-en-3-olate Formula: C13H14N2O5S MolecularWeight: 310.32566

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=C(CCC1=CC=C(C=C1)S(=O)(=O)OC)[O-])[N+]#N

Isomeric SMILES

CC(=O)/C(=C(\CCC1=CC=C(C=C1)S(=O)(=O)OC)/[O-])/[N+]#N

InChI

InChI=1S/C13H14N2O5S/c1-9(16)13(15-14)12(17)8-5-10-3-6-11(7-4-10)21(18,19)20-2/h3-4,6-7H,5,8H2,1-2H3