2-(2-ethoxyphenoxy)-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(2-ethoxyphenoxy)-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-(2-ethoxyphenoxy)-1-[4-(p-tolylsulfonyl)piperazin-1-yl]ethanone CAS Name: 2-(2-ethoxyphenoxy)-1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-(2-ethoxyphenoxy)-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-(2-ethoxyphenoxy)-1-(4-tosylpiperazino)ethanone Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC1=CC=CC=C1OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H26N2O5S/c1-3-27-19-6-4-5-7-20(19)28-16-21(24)22-12-14-23(15-13-22)29(25,26)18-10-8-17(2)9-11-18/h4-11H,3,12-16H2,1-2H3