4-(4-bromanylphenoxy)-1-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]butan-1-one

Systemtic Name: 4-(4-bromanylphenoxy)-1-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]butan-1-one Openeye Name: 4-(4-bromophenoxy)-1-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]butan-1-one CAS Name: 4-(4-bromophenoxy)-1-[4-(2-fluorophenyl)sulfonyl-1-piperazinyl]-1-butanone IUPAC Name: 4-(4-bromophenoxy)-1-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]butan-1-one Traditional Name: 4-(4-bromophenoxy)-1-[4-(2-fluorophenyl)sulfonylpiperazino]butan-1-one Formula: C20H22BrFN2O4S MolecularWeight: 485.367083

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCCOC2=CC=C(C=C2)Br)S(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

C1CN(CCN1C(=O)CCCOC2=CC=C(C=C2)Br)S(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C20H22BrFN2O4S/c21-16-7-9-17(10-8-16)28-15-3-6-20(25)23-11-13-24(14-12-23)29(26,27)19-5-2-1-4-18(19)22/h1-2,4-5,7-10H,3,6,11-15H2