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

Systemtic Name: 3-(4-chlorophenyl)sulfonyl-4-(4-phenylpiperazin-1-yl)quinolin-1-ium Openeye Name: 3-(4-chlorophenyl)sulfonyl-4-(4-phenylpiperazin-1-yl)quinolin-1-ium CAS Name: 3-(4-chlorophenyl)sulfonyl-4-(4-phenyl-1-piperazinyl)quinolin-1-ium IUPAC Name: 3-(4-chlorophenyl)sulfonyl-4-(4-phenylpiperazin-1-yl)quinolin-1-ium Traditional Name: 3-(4-chlorophenyl)sulfonyl-4-(4-phenylpiperazino)quinolin-1-ium Formula: C25H23ClN3O2S+ MolecularWeight: 464.98702

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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=C(C=C5)Cl

Isomeric SMILES

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

InChI

InChI=1S/C25H22ClN3O2S/c26-19-10-12-21(13-11-19)32(30,31)24-18-27-23-9-5-4-8-22(23)25(24)29-16-14-28(15-17-29)20-6-2-1-3-7-20/h1-13,18H,14-17H2/p+1