(Z,7S)-2-diazonio-7-ethenylsulfonyloxy-1-ethoxy-3,6-bis(oxidanylidene)-7-phenyl-hept-1-en-1-olate

Systemtic Name: (Z,7S)-2-diazonio-7-ethenylsulfonyloxy-1-ethoxy-3,6-bis(oxidanylidene)-7-phenyl-hept-1-en-1-olate Openeye Name: (Z,7S)-2-diazonio-1-ethoxy-3,6-dioxo-7-phenyl-7-vinylsulfonyloxy-hept-1-en-1-olate CAS Name: (Z,7S)-2-diazonio-7-ethenylsulfonyloxy-1-ethoxy-3,6-dioxo-7-phenyl-1-hepten-1-olate IUPAC Name: (Z,7S)-2-diazonio-7-ethenylsulfonyloxy-1-ethoxy-3,6-dioxo-7-phenylhept-1-en-1-olate Traditional Name: (Z,7S)-2-diazonio-1-ethoxy-3,6-diketo-7-phenyl-7-vinylsulfonyloxy-hept-1-en-1-olate Formula: C17H18N2O7S MolecularWeight: 394.39902

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C(=O)CCC(=O)C(C1=CC=CC=C1)OS(=O)(=O)C=C)[N+]#N)[O-]

Isomeric SMILES

CCO/C(=C(/C(=O)CCC(=O)[C@H](C1=CC=CC=C1)OS(=O)(=O)C=C)\[N+]#N)/[O-]

InChI

InChI=1S/C17H18N2O7S/c1-3-25-17(22)15(19-18)13(20)10-11-14(21)16(26-27(23,24)4-2)12-8-6-5-7-9-12/h4-9,16H,2-3,10-11H2,1H3/t16-/m0/s1