8-(4-pyridin-1-ium-2-ylpiperazin-1-yl)sulfonylquinoline

Systemtic Name: 8-(4-pyridin-1-ium-2-ylpiperazin-1-yl)sulfonylquinoline Openeye Name: 8-(4-pyridin-1-ium-2-ylpiperazin-1-yl)sulfonylquinoline CAS Name: 8-[[4-(2-pyridin-1-iumyl)-1-piperazinyl]sulfonyl]quinoline IUPAC Name: 8-(4-pyridin-1-ium-2-ylpiperazin-1-yl)sulfonylquinoline Traditional Name: 8-(4-pyridin-1-ium-2-ylpiperazino)sulfonylquinoline Formula: C18H19N4O2S+ MolecularWeight: 355.43406

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C18H18N4O2S/c23-25(24,16-7-3-5-15-6-4-10-20-18(15)16)22-13-11-21(12-14-22)17-8-1-2-9-19-17/h1-10H,11-14H2/p+1