1-(phenylsulfonyl)-4-pyridin-1-ium-2-yl-piperazine

Systemtic Name: 1-(phenylsulfonyl)-4-pyridin-1-ium-2-yl-piperazine Openeye Name: 1-(benzenesulfonyl)-4-pyridin-1-ium-2-yl-piperazine CAS Name: 1-(benzenesulfonyl)-4-(2-pyridin-1-iumyl)piperazine IUPAC Name: 1-(benzenesulfonyl)-4-pyridin-1-ium-2-ylpiperazine Traditional Name: 1-besyl-4-pyridin-1-ium-2-yl-piperazine Formula: C15H18N3O2S+ MolecularWeight: 304.38732

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17N3O2S/c19-21(20,14-6-2-1-3-7-14)18-12-10-17(11-13-18)15-8-4-5-9-16-15/h1-9H,10-13H2/p+1