3-(4-chlorophenyl)sulfonyl-6-fluoranyl-4-(4-phenylpiperazin-1-yl)quinolin-1-ium

Systemtic Name: 3-(4-chlorophenyl)sulfonyl-6-fluoranyl-4-(4-phenylpiperazin-1-yl)quinolin-1-ium Openeye Name: 3-(4-chlorophenyl)sulfonyl-6-fluoro-4-(4-phenylpiperazin-1-yl)quinolin-1-ium CAS Name: 3-(4-chlorophenyl)sulfonyl-6-fluoro-4-(4-phenyl-1-piperazinyl)quinolin-1-ium IUPAC Name: 3-(4-chlorophenyl)sulfonyl-6-fluoro-4-(4-phenylpiperazin-1-yl)quinolin-1-ium Traditional Name: 3-(4-chlorophenyl)sulfonyl-6-fluoro-4-(4-phenylpiperazino)quinolin-1-ium Formula: C25H22ClFN3O2S+ MolecularWeight: 482.977483

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=C4C=C(C=CC4=[NH+]C=C3S(=O)(=O)C5=CC=C(C=C5)Cl)F

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=C4C=C(C=CC4=[NH+]C=C3S(=O)(=O)C5=CC=C(C=C5)Cl)F

InChI

InChI=1S/C25H21ClFN3O2S/c26-18-6-9-21(10-7-18)33(31,32)24-17-28-23-11-8-19(27)16-22(23)25(24)30-14-12-29(13-15-30)20-4-2-1-3-5-20/h1-11,16-17H,12-15H2/p+1