N,4-dimethyl-N-[4-[2-oxidanylidene-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethoxy]phenyl]benzenesulfonamide

Systemtic Name: N,4-dimethyl-N-[4-[2-oxidanylidene-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethoxy]phenyl]benzenesulfonamide Openeye Name: N,4-dimethyl-N-[4-[2-oxo-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethoxy]phenyl]benzenesulfonamide CAS Name: N,4-dimethyl-N-[4-[2-oxo-2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]ethoxy]phenyl]benzenesulfonamide IUPAC Name: N,4-dimethyl-N-[4-[2-oxo-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethoxy]phenyl]benzenesulfonamide Traditional Name: N-[4-[2-keto-2-(4-pyridin-1-ium-2-ylpiperazino)ethoxy]phenyl]-N,4-dimethyl-benzenesulfonamide Formula: C25H29N4O4S+ MolecularWeight: 481.58716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OCC(=O)N3CCN(CC3)C4=CC=CC=[NH+]4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OCC(=O)N3CCN(CC3)C4=CC=CC=[NH+]4

InChI

InChI=1S/C25H28N4O4S/c1-20-6-12-23(13-7-20)34(31,32)27(2)21-8-10-22(11-9-21)33-19-25(30)29-17-15-28(16-18-29)24-5-3-4-14-26-24/h3-14H,15-19H2,1-2H3/p+1