2,4-bis(fluoranyl)-N-[4-oxidanylidene-4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)butyl]benzenesulfonamide

Systemtic Name: 2,4-bis(fluoranyl)-N-[4-oxidanylidene-4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)butyl]benzenesulfonamide Openeye Name: 2,4-difluoro-N-[4-oxo-4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)butyl]benzenesulfonamide CAS Name: 2,4-difluoro-N-[4-oxo-4-[4-(2-pyridin-1-iumyl)-1-piperazinyl]butyl]benzenesulfonamide IUPAC Name: 2,4-difluoro-N-[4-oxo-4-(4-pyridin-1-ium-2-ylpiperazin-1-yl)butyl]benzenesulfonamide Traditional Name: 2,4-difluoro-N-[4-keto-4-(4-pyridin-1-ium-2-ylpiperazino)butyl]benzenesulfonamide Formula: C19H23F2N4O3S+ MolecularWeight: 425.472726

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)CCCNS(=O)(=O)C3=C(C=C(C=C3)F)F

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)CCCNS(=O)(=O)C3=C(C=C(C=C3)F)F

InChI

InChI=1S/C19H22F2N4O3S/c20-15-6-7-17(16(21)14-15)29(27,28)23-9-3-5-19(26)25-12-10-24(11-13-25)18-4-1-2-8-22-18/h1-2,4,6-8,14,23H,3,5,9-13H2/p+1