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

Systemtic Name: (3Z)-3-(4-bromophenyl)sulfonylimino-4-oxidanylidene-2-(3-prop-2-enylimidazol-3-ium-1-yl)naphthalen-1-olate Openeye Name: (3Z)-2-(3-allylimidazol-3-ium-1-yl)-3-(4-bromophenyl)sulfonylimino-4-oxo-naphthalen-1-olate CAS Name: (3Z)-3-(4-bromophenyl)sulfonylimino-4-oxo-2-(3-prop-2-enyl-1-imidazol-3-iumyl)-1-naphthalenolate IUPAC Name: (3Z)-3-(4-bromophenyl)sulfonylimino-4-oxo-2-(3-prop-2-enylimidazol-3-ium-1-yl)naphthalen-1-olate Traditional Name: (3Z)-2-(3-allylimidazol-3-ium-1-yl)-3-brosylimino-4-keto-naphthalen-1-olate Formula: C22H16BrN3O4S MolecularWeight: 498.34914

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Descriptors Computed from Structure

Canonical SMILES:

C=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

C=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/C22H16BrN3O4S/c1-2-11-25-12-13-26(14-25)20-19(21(27)17-5-3-4-6-18(17)22(20)28)24-31(29,30)16-9-7-15(23)8-10-16/h2-10,12-14H,1,11H2