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

Systemtic Name: (3Z)-3-(4-bromophenyl)sulfonylimino-2-(3-methylpyridin-1-ium-1-yl)-4-oxidanylidene-naphthalen-1-olate Openeye Name: (3Z)-3-(4-bromophenyl)sulfonylimino-2-(3-methylpyridin-1-ium-1-yl)-4-oxo-naphthalen-1-olate CAS Name: (3Z)-3-(4-bromophenyl)sulfonylimino-2-(3-methyl-1-pyridin-1-iumyl)-4-oxo-1-naphthalenolate IUPAC Name: (3Z)-3-(4-bromophenyl)sulfonylimino-2-(3-methylpyridin-1-ium-1-yl)-4-oxonaphthalen-1-olate Traditional Name: (3Z)-3-brosylimino-4-keto-2-(3-methylpyridin-1-ium-1-yl)naphthalen-1-olate Formula: C22H15BrN2O4S MolecularWeight: 483.3345

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](=CC=C1)C2=C(C3=CC=CC=C3C(=O)C2=NS(=O)(=O)C4=CC=C(C=C4)Br)[O-]

Isomeric SMILES

CC1=C[N+](=CC=C1)C\2=C(C3=CC=CC=C3C(=O)/C2=N\S(=O)(=O)C4=CC=C(C=C4)Br)[O-]

InChI

InChI=1S/C22H15BrN2O4S/c1-14-5-4-12-25(13-14)20-19(21(26)17-6-2-3-7-18(17)22(20)27)24-30(28,29)16-10-8-15(23)9-11-16/h2-13H,1H3