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

Systemtic Name: N-[3-isoquinolin-2-ium-2-yl-1,4-bis(oxidanylidene)naphthalen-2-yl]-4-methyl-benzenesulfonamide Openeye Name: N-(3-isoquinolin-2-ium-2-yl-1,4-dioxo-2-naphthyl)-4-methyl-benzenesulfonamide CAS Name: N-[3-(2-isoquinolin-2-iumyl)-1,4-dioxo-2-naphthalenyl]-4-methylbenzenesulfonamide IUPAC Name: N-(3-isoquinolin-2-ium-2-yl-1,4-dioxonaphthalen-2-yl)-4-methylbenzenesulfonamide Traditional Name: N-(3-isoquinolin-2-ium-2-yl-1,4-diketo-2-naphthyl)-4-methyl-benzenesulfonamide Formula: C26H19N2O4S+ MolecularWeight: 455.50506

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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)[N+]4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=O)C3=CC=CC=C3C2=O)[N+]4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C26H18N2O4S/c1-17-10-12-20(13-11-17)33(31,32)27-23-24(26(30)22-9-5-4-8-21(22)25(23)29)28-15-14-18-6-2-3-7-19(18)16-28/h2-16H,1H3/p+1