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

Systemtic Name: 4-bromanyl-N-[3-[3-(3-methylbutyl)imidazol-3-ium-1-yl]-1,4-bis(oxidanylidene)naphthalen-2-yl]benzenesulfonamide Openeye Name: 4-bromo-N-[3-(3-isopentylimidazol-3-ium-1-yl)-1,4-dioxo-2-naphthyl]benzenesulfonamide CAS Name: 4-bromo-N-[3-[3-(3-methylbutyl)-1-imidazol-3-iumyl]-1,4-dioxo-2-naphthalenyl]benzenesulfonamide IUPAC Name: 4-bromo-N-[3-[3-(3-methylbutyl)imidazol-3-ium-1-yl]-1,4-dioxonaphthalen-2-yl]benzenesulfonamide Traditional Name: 4-bromo-N-[3-(3-isoamylimidazol-3-ium-1-yl)-1,4-diketo-2-naphthyl]benzenesulfonamide Formula: C24H23BrN3O4S+ MolecularWeight: 529.42612

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC[N+]1=CN(C=C1)C2=C(C(=O)C3=CC=CC=C3C2=O)NS(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CC(C)CC[N+]1=CN(C=C1)C2=C(C(=O)C3=CC=CC=C3C2=O)NS(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C24H22BrN3O4S/c1-16(2)11-12-27-13-14-28(15-27)22-21(23(29)19-5-3-4-6-20(19)24(22)30)26-33(31,32)18-9-7-17(25)8-10-18/h3-10,13-16H,11-12H2,1-2H3/p+1