N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-oxidanylidene-3,4-dihydro-1H-quinoline-6-sulfonamide

Systemtic Name: N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-oxidanylidene-3,4-dihydro-1H-quinoline-6-sulfonamide Openeye Name: N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-oxo-3,4-dihydro-1H-quinoline-6-sulfonamide CAS Name: N-[2-(4-methyl-1-piperazin-4-iumyl)phenyl]-2-oxo-3,4-dihydro-1H-quinoline-6-sulfonamide IUPAC Name: N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-oxo-3,4-dihydro-1H-quinoline-6-sulfonamide Traditional Name: 2-keto-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3,4-dihydro-1H-quinoline-6-sulfonamide Formula: C20H25N4O3S+ MolecularWeight: 401.5025

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=CC=C2NS(=O)(=O)C3=CC4=C(C=C3)NC(=O)CC4

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=CC=C2NS(=O)(=O)C3=CC4=C(C=C3)NC(=O)CC4

InChI

InChI=1S/C20H24N4O3S/c1-23-10-12-24(13-11-23)19-5-3-2-4-18(19)22-28(26,27)16-7-8-17-15(14-16)6-9-20(25)21-17/h2-5,7-8,14,22H,6,9-13H2,1H3,(H,21,25)/p+1