(E)-2-diazonio-1-[(2-oxidanylideneoxetan-3-yl)-(phenylmethyl)amino]-2-phenylperoxysulfanyl-ethenolate

Systemtic Name: (E)-2-diazonio-1-[(2-oxidanylideneoxetan-3-yl)-(phenylmethyl)amino]-2-phenylperoxysulfanyl-ethenolate Openeye Name: (E)-1-[benzyl-(2-oxooxetan-3-yl)amino]-2-diazonio-2-phenylperoxysulfanyl-ethenolate CAS Name: (E)-2-diazonio-1-[(2-oxo-3-oxetanyl)-(phenylmethyl)amino]-2-(phenyldioxythio)ethenolate IUPAC Name: (E)-1-[benzyl-(2-oxooxetan-3-yl)amino]-2-diazonio-2-phenylperoxysulfanylethenolate Traditional Name: (E)-1-[benzyl-(2-ketooxetan-3-yl)amino]-2-diazonio-2-(phenylperoxythio)ethenolate Formula: C18H15N3O5S MolecularWeight: 385.3938

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)O1)N(CC2=CC=CC=C2)C(=C([N+]#N)SOOC3=CC=CC=C3)[O-]

Isomeric SMILES

C1C(C(=O)O1)N(CC2=CC=CC=C2)/C(=C(/[N+]#N)\SOOC3=CC=CC=C3)/[O-]

InChI

InChI=1S/C18H15N3O5S/c19-20-16(27-26-25-14-9-5-2-6-10-14)17(22)21(15-12-24-18(15)23)11-13-7-3-1-4-8-13/h1-10,15H,11-12H2/b17-16+