4-bromanyl-N-[3-(4-tert-butylpyridin-1-ium-1-yl)-1,4-bis(oxidanylidene)naphthalen-2-yl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[3-(4-tert-butylpyridin-1-ium-1-yl)-1,4-bis(oxidanylidene)naphthalen-2-yl]benzenesulfonamide Openeye Name: 4-bromo-N-[3-(4-tert-butylpyridin-1-ium-1-yl)-1,4-dioxo-2-naphthyl]benzenesulfonamide CAS Name: 4-bromo-N-[3-(4-tert-butyl-1-pyridin-1-iumyl)-1,4-dioxo-2-naphthalenyl]benzenesulfonamide IUPAC Name: 4-bromo-N-[3-(4-tert-butylpyridin-1-ium-1-yl)-1,4-dioxonaphthalen-2-yl]benzenesulfonamide Traditional Name: 4-bromo-N-[3-(4-tert-butylpyridin-1-ium-1-yl)-1,4-diketo-2-naphthyl]benzenesulfonamide Formula: C25H22BrN2O4S+ MolecularWeight: 526.42218

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H21BrN2O4S/c1-25(2,3)16-12-14-28(15-13-16)22-21(23(29)19-6-4-5-7-20(19)24(22)30)27-33(31,32)18-10-8-17(26)9-11-18/h4-15H,1-3H3/p+1