3-(2-ethoxyphenoxy)-1-[4-(phenylsulfonyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(2-ethoxyphenoxy)-1-[4-(phenylsulfonyl)piperazin-1-yl]propan-1-one Openeye Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-3-(2-ethoxyphenoxy)propan-1-one CAS Name: 1-[4-(benzenesulfonyl)-1-piperazinyl]-3-(2-ethoxyphenoxy)-1-propanone IUPAC Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-3-(2-ethoxyphenoxy)propan-1-one Traditional Name: 1-(4-besylpiperazino)-3-(2-ethoxyphenoxy)propan-1-one Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1OCCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=CC=C1OCCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

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