N-[3-(3-methylbenzimidazol-3-ium-1-yl)-1,4-bis(oxidanylidene)naphthalen-2-yl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[3-(3-methylbenzimidazol-3-ium-1-yl)-1,4-bis(oxidanylidene)naphthalen-2-yl]-4-nitro-benzenesulfonamide Openeye Name: N-[3-(3-methylbenzimidazol-3-ium-1-yl)-1,4-dioxo-2-naphthyl]-4-nitro-benzenesulfonamide CAS Name: N-[3-(3-methyl-1-benzimidazol-3-iumyl)-1,4-dioxo-2-naphthalenyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[3-(3-methylbenzimidazol-3-ium-1-yl)-1,4-dioxonaphthalen-2-yl]-4-nitrobenzenesulfonamide Traditional Name: N-[1,4-diketo-3-(3-methylbenzimidazol-3-ium-1-yl)-2-naphthyl]-4-nitro-benzenesulfonamide Formula: C24H17N4O6S+ MolecularWeight: 489.47998

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C2=CC=CC=C21)C3=C(C(=O)C4=CC=CC=C4C3=O)NS(=O)(=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C[N+]1=CN(C2=CC=CC=C21)C3=C(C(=O)C4=CC=CC=C4C3=O)NS(=O)(=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C24H16N4O6S/c1-26-14-27(20-9-5-4-8-19(20)26)22-21(23(29)17-6-2-3-7-18(17)24(22)30)25-35(33,34)16-12-10-15(11-13-16)28(31)32/h2-14H,1H3/p+1