4-(4-phenylpiperazin-1-yl)-3-(phenylsulfonyl)quinolin-1-ium

Systemtic Name: 4-(4-phenylpiperazin-1-yl)-3-(phenylsulfonyl)quinolin-1-ium Openeye Name: 3-(benzenesulfonyl)-4-(4-phenylpiperazin-1-yl)quinolin-1-ium CAS Name: 3-(benzenesulfonyl)-4-(4-phenyl-1-piperazinyl)quinolin-1-ium IUPAC Name: 3-(benzenesulfonyl)-4-(4-phenylpiperazin-1-yl)quinolin-1-ium Traditional Name: 3-besyl-4-(4-phenylpiperazino)quinolin-1-ium Formula: C25H24N3O2S+ MolecularWeight: 430.54196

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=C(C=[NH+]C4=CC=CC=C43)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=C(C=[NH+]C4=CC=CC=C43)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C25H23N3O2S/c29-31(30,21-11-5-2-6-12-21)24-19-26-23-14-8-7-13-22(23)25(24)28-17-15-27(16-18-28)20-9-3-1-4-10-20/h1-14,19H,15-18H2/p+1