1-[4-ethoxy-3-[[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]methyl]phenyl]ethanone

Systemtic Name: 1-[4-ethoxy-3-[[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]methyl]phenyl]ethanone Openeye Name: 1-[4-ethoxy-3-[[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]methyl]phenyl]ethanone CAS Name: 1-[4-ethoxy-3-[[4-(4-fluorophenyl)sulfonyl-1-piperazinyl]methyl]phenyl]ethanone IUPAC Name: 1-[4-ethoxy-3-[[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]methyl]phenyl]ethanone Traditional Name: 1-[4-ethoxy-3-[[4-(4-fluorophenyl)sulfonylpiperazino]methyl]phenyl]ethanone Formula: C21H25FN2O4S MolecularWeight: 420.497603

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

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