(2-methoxyphenyl) 2-[4-[2-(2-methoxyphenoxy)sulfonylethyl]piperazin-1-yl]ethanesulfonate

Systemtic Name: (2-methoxyphenyl) 2-[4-[2-(2-methoxyphenoxy)sulfonylethyl]piperazin-1-yl]ethanesulfonate Openeye Name: (2-methoxyphenyl) 2-[4-[2-(2-methoxyphenoxy)sulfonylethyl]piperazin-1-yl]ethanesulfonate CAS Name: 2-[4-[2-(2-methoxyphenoxy)sulfonylethyl]-1-piperazinyl]ethanesulfonic acid (2-methoxyphenyl) ester IUPAC Name: (2-methoxyphenyl) 2-[4-[2-(2-methoxyphenoxy)sulfonylethyl]piperazin-1-yl]ethanesulfonate Traditional Name: 2-[4-[2-(2-methoxyphenoxy)sulfonylethyl]piperazino]ethanesulfonic acid (2-methoxyphenyl) ester Formula: C22H30N2O8S2 MolecularWeight: 514.6122

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OS(=O)(=O)CCN2CCN(CC2)CCS(=O)(=O)OC3=CC=CC=C3OC

Isomeric SMILES

COC1=CC=CC=C1OS(=O)(=O)CCN2CCN(CC2)CCS(=O)(=O)OC3=CC=CC=C3OC

InChI

InChI=1S/C22H30N2O8S2/c1-29-19-7-3-5-9-21(19)31-33(25,26)17-15-23-11-13-24(14-12-23)16-18-34(27,28)32-22-10-6-4-8-20(22)30-2/h3-10H,11-18H2,1-2H3