N,N-diethyl-6-[4-(2-fluorophenyl)piperazin-1-yl]pyridin-1-ium-3-sulfonamide

Systemtic Name: N,N-diethyl-6-[4-(2-fluorophenyl)piperazin-1-yl]pyridin-1-ium-3-sulfonamide Openeye Name: N,N-diethyl-6-[4-(2-fluorophenyl)piperazin-1-yl]pyridin-1-ium-3-sulfonamide CAS Name: N,N-diethyl-6-[4-(2-fluorophenyl)-1-piperazinyl]-3-pyridin-1-iumsulfonamide IUPAC Name: N,N-diethyl-6-[4-(2-fluorophenyl)piperazin-1-yl]pyridin-1-ium-3-sulfonamide Traditional Name: N,N-diethyl-6-[4-(2-fluorophenyl)piperazino]pyridin-1-ium-3-sulfonamide Formula: C19H26FN4O2S+ MolecularWeight: 393.498743

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C[NH+]=C(C=C1)N2CCN(CC2)C3=CC=CC=C3F

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C[NH+]=C(C=C1)N2CCN(CC2)C3=CC=CC=C3F

InChI

InChI=1S/C19H25FN4O2S/c1-3-24(4-2)27(25,26)16-9-10-19(21-15-16)23-13-11-22(12-14-23)18-8-6-5-7-17(18)20/h5-10,15H,3-4,11-14H2,1-2H3/p+1