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

Systemtic Name: N-[1,4-bis(oxidanylidene)-3-(3-propan-2-ylimidazol-3-ium-1-yl)naphthalen-2-yl]benzenesulfonamide Openeye Name: N-[3-(3-isopropylimidazol-3-ium-1-yl)-1,4-dioxo-2-naphthyl]benzenesulfonamide CAS Name: N-[1,4-dioxo-3-(3-propan-2-yl-1-imidazol-3-iumyl)-2-naphthalenyl]benzenesulfonamide IUPAC Name: N-[1,4-dioxo-3-(3-propan-2-ylimidazol-3-ium-1-yl)naphthalen-2-yl]benzenesulfonamide Traditional Name: N-[3-(3-isopropylimidazol-3-ium-1-yl)-1,4-diketo-2-naphthyl]benzenesulfonamide Formula: C22H20N3O4S+ MolecularWeight: 422.4769

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19N3O4S/c1-15(2)24-12-13-25(14-24)20-19(23-30(28,29)16-8-4-3-5-9-16)21(26)17-10-6-7-11-18(17)22(20)27/h3-15H,1-2H3/p+1