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

Systemtic Name: 4-bromanyl-N-[3-(3,5-dimethylpyridin-1-ium-1-yl)-1,4-bis(oxidanylidene)naphthalen-2-yl]benzenesulfonamide Openeye Name: 4-bromo-N-[3-(3,5-dimethylpyridin-1-ium-1-yl)-1,4-dioxo-2-naphthyl]benzenesulfonamide CAS Name: 4-bromo-N-[3-(3,5-dimethyl-1-pyridin-1-iumyl)-1,4-dioxo-2-naphthalenyl]benzenesulfonamide IUPAC Name: 4-bromo-N-[3-(3,5-dimethylpyridin-1-ium-1-yl)-1,4-dioxonaphthalen-2-yl]benzenesulfonamide Traditional Name: 4-bromo-N-[3-(3,5-dimethylpyridin-1-ium-1-yl)-1,4-diketo-2-naphthyl]benzenesulfonamide Formula: C23H18BrN2O4S+ MolecularWeight: 498.36902

Click to see the large picture

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)Br)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)Br)C

InChI

InChI=1S/C23H17BrN2O4S/c1-14-11-15(2)13-26(12-14)21-20(22(27)18-5-3-4-6-19(18)23(21)28)25-31(29,30)17-9-7-16(24)8-10-17/h3-13H,1-2H3/p+1