1-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]-4-(4-fluoranylphenoxy)butan-1-one

Systemtic Name: 1-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]-4-(4-fluoranylphenoxy)butan-1-one Openeye Name: 1-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazin-1-yl]-4-(4-fluorophenoxy)butan-1-one CAS Name: 1-[4-(3-chloro-4-fluorophenyl)sulfonyl-1-piperazinyl]-4-(4-fluorophenoxy)-1-butanone IUPAC Name: 1-[4-(3-chloro-4-fluorophenyl)sulfonylpiperazin-1-yl]-4-(4-fluorophenoxy)butan-1-one Traditional Name: 1-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazino]-4-(4-fluorophenoxy)butan-1-one Formula: C20H21ClF2N2O4S MolecularWeight: 458.906546

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCCOC2=CC=C(C=C2)F)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1CN(CCN1C(=O)CCCOC2=CC=C(C=C2)F)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C20H21ClF2N2O4S/c21-18-14-17(7-8-19(18)23)30(27,28)25-11-9-24(10-12-25)20(26)2-1-13-29-16-5-3-15(22)4-6-16/h3-8,14H,1-2,9-13H2