(E)-2-diazonio-1-[(2S)-2-methoxycarbonyl-5-oxidanylidene-pyrrolidin-1-yl]-2-(phenylsulfonyl)ethenolate

Systemtic Name: (E)-2-diazonio-1-[(2S)-2-methoxycarbonyl-5-oxidanylidene-pyrrolidin-1-yl]-2-(phenylsulfonyl)ethenolate Openeye Name: (E)-2-(benzenesulfonyl)-2-diazonio-1-[(2S)-2-methoxycarbonyl-5-oxo-pyrrolidin-1-yl]ethenolate CAS Name: (E)-2-(benzenesulfonyl)-2-diazonio-1-[(2S)-2-methoxycarbonyl-5-oxo-1-pyrrolidinyl]ethenolate IUPAC Name: (E)-2-(benzenesulfonyl)-2-diazonio-1-[(2S)-2-methoxycarbonyl-5-oxopyrrolidin-1-yl]ethenolate Traditional Name: (E)-2-besyl-1-[(2S)-2-carbomethoxy-5-keto-pyrrolidino]-2-diazonio-ethenolate Formula: C14H13N3O6S MolecularWeight: 351.33452

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC(=O)N1C(=C([N+]#N)S(=O)(=O)C2=CC=CC=C2)[O-]

Isomeric SMILES

COC(=O)[C@@H]1CCC(=O)N1/C(=C(/[N+]#N)\S(=O)(=O)C2=CC=CC=C2)/[O-]

InChI

InChI=1S/C14H13N3O6S/c1-23-14(20)10-7-8-11(18)17(10)13(19)12(16-15)24(21,22)9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3/b13-12+/t10-/m0/s1