1-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]-3-(4-ethoxyphenoxy)propan-1-one

Systemtic Name: 1-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]-3-(4-ethoxyphenoxy)propan-1-one Openeye Name: 1-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazin-1-yl]-3-(4-ethoxyphenoxy)propan-1-one CAS Name: 1-[4-(3-chloro-4-fluorophenyl)sulfonyl-1-piperazinyl]-3-(4-ethoxyphenoxy)-1-propanone IUPAC Name: 1-[4-(3-chloro-4-fluorophenyl)sulfonylpiperazin-1-yl]-3-(4-ethoxyphenoxy)propan-1-one Traditional Name: 1-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazino]-3-(4-ethoxyphenoxy)propan-1-one Formula: C21H24ClFN2O5S MolecularWeight: 470.942063

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)OCCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C21H24ClFN2O5S/c1-2-29-16-3-5-17(6-4-16)30-14-9-21(26)24-10-12-25(13-11-24)31(27,28)18-7-8-20(23)19(22)15-18/h3-8,15H,2,9-14H2,1H3