(3E)-2-(3-ethenylimidazol-3-ium-1-yl)-3-(4-nitrophenyl)sulfonylimino-4-oxidanylidene-naphthalen-1-olate

Systemtic Name: (3E)-2-(3-ethenylimidazol-3-ium-1-yl)-3-(4-nitrophenyl)sulfonylimino-4-oxidanylidene-naphthalen-1-olate Openeye Name: (3E)-3-(4-nitrophenyl)sulfonylimino-4-oxo-2-(3-vinylimidazol-3-ium-1-yl)naphthalen-1-olate CAS Name: (3E)-2-(3-ethenyl-1-imidazol-3-iumyl)-3-(4-nitrophenyl)sulfonylimino-4-oxo-1-naphthalenolate IUPAC Name: (3E)-2-(3-ethenylimidazol-3-ium-1-yl)-3-(4-nitrophenyl)sulfonylimino-4-oxonaphthalen-1-olate Traditional Name: (3E)-4-keto-3-nosylimino-2-(3-vinylimidazol-3-ium-1-yl)naphthalen-1-olate Formula: C21H14N4O6S MolecularWeight: 450.42406

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Descriptors Computed from Structure

Canonical SMILES:

C=C[N+]1=CN(C=C1)C2=C(C3=CC=CC=C3C(=O)C2=NS(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-])[O-]

Isomeric SMILES

C=C[N+]1=CN(C=C1)C\2=C(C3=CC=CC=C3C(=O)/C2=N/S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-])[O-]

InChI

InChI=1S/C21H14N4O6S/c1-2-23-11-12-24(13-23)19-18(20(26)16-5-3-4-6-17(16)21(19)27)22-32(30,31)15-9-7-14(8-10-15)25(28)29/h2-13H,1H2