1-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-2-[4-(pyridin-2-ylmethyl)piperazin-1-ium-1-yl]ethanone

Systemtic Name: 1-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-2-[4-(pyridin-2-ylmethyl)piperazin-1-ium-1-yl]ethanone Openeye Name: 1-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-2-[4-(2-pyridylmethyl)piperazin-1-ium-1-yl]ethanone CAS Name: 1-[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]-2-[4-(2-pyridinylmethyl)-1-piperazin-1-iumyl]ethanone IUPAC Name: 1-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-2-[4-(pyridin-2-ylmethyl)piperazin-1-ium-1-yl]ethanone Traditional Name: 1-[4-(4-methoxyphenyl)sulfonylpiperazino]-2-[4-(2-pyridylmethyl)piperazin-1-ium-1-yl]ethanone Formula: C23H32N5O4S+ MolecularWeight: 474.59628

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C[NH+]3CCN(CC3)CC4=CC=CC=N4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C[NH+]3CCN(CC3)CC4=CC=CC=N4

InChI

InChI=1S/C23H31N5O4S/c1-32-21-5-7-22(8-6-21)33(30,31)28-16-14-27(15-17-28)23(29)19-26-12-10-25(11-13-26)18-20-4-2-3-9-24-20/h2-9H,10-19H2,1H3/p+1