1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]ethanone

Systemtic Name: 1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]ethanone Openeye Name: 1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]ethanone CAS Name: 1-[4-(4-fluorophenyl)sulfonyl-1-piperazinyl]-2-[4-(2-hydroxyphenyl)-1-piperazin-1-iumyl]ethanone IUPAC Name: 1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]ethanone Traditional Name: 1-[4-(4-fluorophenyl)sulfonylpiperazino]-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]ethanone Formula: C22H28FN4O4S+ MolecularWeight: 463.545523

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F)C4=CC=CC=C4O

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F)C4=CC=CC=C4O

InChI

InChI=1S/C22H27FN4O4S/c23-18-5-7-19(8-6-18)32(30,31)27-15-13-26(14-16-27)22(29)17-24-9-11-25(12-10-24)20-3-1-2-4-21(20)28/h1-8,28H,9-17H2/p+1