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

Systemtic Name: N-[1,4-bis(oxidanylidene)-3-(4-phenoxypyridin-1-ium-1-yl)naphthalen-2-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[1,4-dioxo-3-(4-phenoxypyridin-1-ium-1-yl)-2-naphthyl]-4-methyl-benzenesulfonamide CAS Name: N-[1,4-dioxo-3-(4-phenoxy-1-pyridin-1-iumyl)-2-naphthalenyl]-4-methylbenzenesulfonamide IUPAC Name: N-[1,4-dioxo-3-(4-phenoxypyridin-1-ium-1-yl)naphthalen-2-yl]-4-methylbenzenesulfonamide Traditional Name: N-[1,4-diketo-3-(4-phenoxypyridin-1-ium-1-yl)-2-naphthyl]-4-methyl-benzenesulfonamide Formula: C28H21N2O5S+ MolecularWeight: 497.54174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=O)C3=CC=CC=C3C2=O)[N+]4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=O)C3=CC=CC=C3C2=O)[N+]4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C28H20N2O5S/c1-19-11-13-22(14-12-19)36(33,34)29-25-26(28(32)24-10-6-5-9-23(24)27(25)31)30-17-15-21(16-18-30)35-20-7-3-2-4-8-20/h2-18H,1H3/p+1