(3Z)-3-(4-bromophenyl)sulfonylimino-2-(3-ethylimidazol-3-ium-1-yl)-4-oxidanylidene-naphthalen-1-olate

Systemtic Name: (3Z)-3-(4-bromophenyl)sulfonylimino-2-(3-ethylimidazol-3-ium-1-yl)-4-oxidanylidene-naphthalen-1-olate Openeye Name: (3Z)-3-(4-bromophenyl)sulfonylimino-2-(3-ethylimidazol-3-ium-1-yl)-4-oxo-naphthalen-1-olate CAS Name: (3Z)-3-(4-bromophenyl)sulfonylimino-2-(3-ethyl-1-imidazol-3-iumyl)-4-oxo-1-naphthalenolate IUPAC Name: (3Z)-3-(4-bromophenyl)sulfonylimino-2-(3-ethylimidazol-3-ium-1-yl)-4-oxonaphthalen-1-olate Traditional Name: (3Z)-3-brosylimino-2-(3-ethylimidazol-3-ium-1-yl)-4-keto-naphthalen-1-olate Formula: C21H16BrN3O4S MolecularWeight: 486.33844

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H16BrN3O4S/c1-2-24-11-12-25(13-24)19-18(20(26)16-5-3-4-6-17(16)21(19)27)23-30(28,29)15-9-7-14(22)8-10-15/h3-13H,2H2,1H3