2-[4-(phenylsulfonyl)piperazin-1-yl]quinolin-1-ium

Systemtic Name: 2-[4-(phenylsulfonyl)piperazin-1-yl]quinolin-1-ium Openeye Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]quinolin-1-ium CAS Name: 2-[4-(benzenesulfonyl)-1-piperazinyl]quinolin-1-ium IUPAC Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]quinolin-1-ium Traditional Name: 2-(4-besylpiperazino)quinolin-1-ium Formula: C19H20N3O2S+ MolecularWeight: 354.446

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=[NH+]C3=CC=CC=C3C=C2)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=[NH+]C3=CC=CC=C3C=C2)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C19H19N3O2S/c23-25(24,17-7-2-1-3-8-17)22-14-12-21(13-15-22)19-11-10-16-6-4-5-9-18(16)20-19/h1-11H,12-15H2/p+1