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

Systemtic Name: N-[1,4-bis(oxidanylidene)-3-(3-propan-2-ylimidazol-3-ium-1-yl)naphthalen-2-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[3-(3-isopropylimidazol-3-ium-1-yl)-1,4-dioxo-2-naphthyl]-4-methyl-benzenesulfonamide CAS Name: N-[1,4-dioxo-3-(3-propan-2-yl-1-imidazol-3-iumyl)-2-naphthalenyl]-4-methylbenzenesulfonamide IUPAC Name: N-[1,4-dioxo-3-(3-propan-2-ylimidazol-3-ium-1-yl)naphthalen-2-yl]-4-methylbenzenesulfonamide Traditional Name: N-[3-(3-isopropylimidazol-3-ium-1-yl)-1,4-diketo-2-naphthyl]-4-methyl-benzenesulfonamide Formula: C23H22N3O4S+ MolecularWeight: 436.50348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=O)C3=CC=CC=C3C2=O)N4C=C[N+](=C4)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=O)C3=CC=CC=C3C2=O)N4C=C[N+](=C4)C(C)C

InChI

InChI=1S/C23H21N3O4S/c1-15(2)25-12-13-26(14-25)21-20(22(27)18-6-4-5-7-19(18)23(21)28)24-31(29,30)17-10-8-16(3)9-11-17/h4-15H,1-3H3/p+1