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

Systemtic Name: 2-(2-ethoxyphenoxy)-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-(2-ethoxyphenoxy)ethanone CAS Name: 2-(2-ethoxyphenoxy)-1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-(2-ethoxyphenoxy)ethanone Traditional Name: 1-(4-benzylsulfonylpiperazino)-2-(2-ethoxyphenoxy)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)CC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=CC=C1OCC(=O)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O5S/c1-2-27-19-10-6-7-11-20(19)28-16-21(24)22-12-14-23(15-13-22)29(25,26)17-18-8-4-3-5-9-18/h3-11H,2,12-17H2,1H3