3-(4-chlorophenyl)sulfonyl-6-ethoxy-4-(4-ethylpiperazin-4-ium-1-yl)quinoline

Systemtic Name: 3-(4-chlorophenyl)sulfonyl-6-ethoxy-4-(4-ethylpiperazin-4-ium-1-yl)quinoline Openeye Name: 3-(4-chlorophenyl)sulfonyl-6-ethoxy-4-(4-ethylpiperazin-4-ium-1-yl)quinoline CAS Name: 3-(4-chlorophenyl)sulfonyl-6-ethoxy-4-(4-ethyl-1-piperazin-4-iumyl)quinoline IUPAC Name: 3-(4-chlorophenyl)sulfonyl-6-ethoxy-4-(4-ethylpiperazin-4-ium-1-yl)quinoline Traditional Name: 3-(4-chlorophenyl)sulfonyl-6-ethoxy-4-(4-ethylpiperazin-4-ium-1-yl)quinoline Formula: C23H27ClN3O3S+ MolecularWeight: 460.99678

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C3C=C(C=CC3=NC=C2S(=O)(=O)C4=CC=C(C=C4)Cl)OCC

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C3C=C(C=CC3=NC=C2S(=O)(=O)C4=CC=C(C=C4)Cl)OCC

InChI

InChI=1S/C23H26ClN3O3S/c1-3-26-11-13-27(14-12-26)23-20-15-18(30-4-2)7-10-21(20)25-16-22(23)31(28,29)19-8-5-17(24)6-9-19/h5-10,15-16H,3-4,11-14H2,1-2H3/p+1