1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-2-(2,4,6-trimethylphenoxy)ethanone

Systemtic Name: 1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-2-(2,4,6-trimethylphenoxy)ethanone Openeye Name: 1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-2-(2,4,6-trimethylphenoxy)ethanone CAS Name: 1-[4-(4-fluorophenyl)sulfonyl-1-piperazinyl]-2-(2,4,6-trimethylphenoxy)ethanone IUPAC Name: 1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-2-(2,4,6-trimethylphenoxy)ethanone Traditional Name: 1-[4-(4-fluorophenyl)sulfonylpiperazino]-2-(2,4,6-trimethylphenoxy)ethanone Formula: C21H25FN2O4S MolecularWeight: 420.497603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C21H25FN2O4S/c1-15-12-16(2)21(17(3)13-15)28-14-20(25)23-8-10-24(11-9-23)29(26,27)19-6-4-18(22)5-7-19/h4-7,12-13H,8-11,14H2,1-3H3