2-(2-butan-2-ylphenoxy)-1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(2-butan-2-ylphenoxy)-1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-2-(2-sec-butylphenoxy)ethanone CAS Name: 2-(2-butan-2-ylphenoxy)-1-[4-(4-fluorophenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-(2-butan-2-ylphenoxy)-1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 1-[4-(4-fluorophenyl)sulfonylpiperazino]-2-(2-sec-butylphenoxy)ethanone Formula: C22H27FN2O4S MolecularWeight: 434.524183

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCC(C)C1=CC=CC=C1OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H27FN2O4S/c1-3-17(2)20-6-4-5-7-21(20)29-16-22(26)24-12-14-25(15-13-24)30(27,28)19-10-8-18(23)9-11-19/h4-11,17H,3,12-16H2,1-2H3