N-[3-(3,5-dimethylpyridin-1-ium-1-yl)-1,4-bis(oxidanylidene)naphthalen-2-yl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[3-(3,5-dimethylpyridin-1-ium-1-yl)-1,4-bis(oxidanylidene)naphthalen-2-yl]-4-nitro-benzenesulfonamide Openeye Name: N-[3-(3,5-dimethylpyridin-1-ium-1-yl)-1,4-dioxo-2-naphthyl]-4-nitro-benzenesulfonamide CAS Name: N-[3-(3,5-dimethyl-1-pyridin-1-iumyl)-1,4-dioxo-2-naphthalenyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[3-(3,5-dimethylpyridin-1-ium-1-yl)-1,4-dioxonaphthalen-2-yl]-4-nitrobenzenesulfonamide Traditional Name: N-[3-(3,5-dimethylpyridin-1-ium-1-yl)-1,4-diketo-2-naphthyl]-4-nitro-benzenesulfonamide Formula: C23H18N3O6S+ MolecularWeight: 464.47052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C[N+](=C1)C2=C(C(=O)C3=CC=CC=C3C2=O)NS(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C[N+](=C1)C2=C(C(=O)C3=CC=CC=C3C2=O)NS(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-])C

InChI

InChI=1S/C23H17N3O6S/c1-14-11-15(2)13-25(12-14)21-20(22(27)18-5-3-4-6-19(18)23(21)28)24-33(31,32)17-9-7-16(8-10-17)26(29)30/h3-13H,1-2H3/p+1