(3E)-3-(4-acetamidophenyl)sulfonylimino-2-(3-methylbenzimidazol-3-ium-1-yl)-4-oxidanylidene-naphthalen-1-olate

Systemtic Name: (3E)-3-(4-acetamidophenyl)sulfonylimino-2-(3-methylbenzimidazol-3-ium-1-yl)-4-oxidanylidene-naphthalen-1-olate Openeye Name: (3E)-3-(4-acetamidophenyl)sulfonylimino-2-(3-methylbenzimidazol-3-ium-1-yl)-4-oxo-naphthalen-1-olate CAS Name: (3E)-3-(4-acetamidophenyl)sulfonylimino-2-(3-methyl-1-benzimidazol-3-iumyl)-4-oxo-1-naphthalenolate IUPAC Name: (3E)-3-(4-acetamidophenyl)sulfonylimino-2-(3-methylbenzimidazol-3-ium-1-yl)-4-oxonaphthalen-1-olate Traditional Name: (3E)-3-(4-acetamidophenyl)sulfonylimino-4-keto-2-(3-methylbenzimidazol-3-ium-1-yl)naphthalen-1-olate Formula: C26H20N4O5S MolecularWeight: 500.5258

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N=C2C(=C(C3=CC=CC=C3C2=O)[O-])N4C=[N+](C5=CC=CC=C54)C

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)/N=C/2\C(=C(C3=CC=CC=C3C2=O)[O-])N4C=[N+](C5=CC=CC=C54)C

InChI

InChI=1S/C26H20N4O5S/c1-16(31)27-17-11-13-18(14-12-17)36(34,35)28-23-24(26(33)20-8-4-3-7-19(20)25(23)32)30-15-29(2)21-9-5-6-10-22(21)30/h3-15H,1-2H3,(H-,27,28,31,33)