(4-bromanyl-2-fluoranyl-phenyl)methyl 2-(4-piperidin-1-ylsulfonylphenyl)ethanoate

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl)methyl 2-(4-piperidin-1-ylsulfonylphenyl)ethanoate Openeye Name: (4-bromo-2-fluoro-phenyl)methyl 2-[4-(1-piperidylsulfonyl)phenyl]acetate CAS Name: 2-[4-(1-piperidinylsulfonyl)phenyl]acetic acid (4-bromo-2-fluorophenyl)methyl ester IUPAC Name: (4-bromo-2-fluorophenyl)methyl 2-(4-piperidin-1-ylsulfonylphenyl)acetate Traditional Name: 2-(4-piperidinosulfonylphenyl)acetic acid (4-bromo-2-fluoro-benzyl) ester Formula: C20H21BrFNO4S MolecularWeight: 470.352443

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CC(=O)OCC3=C(C=C(C=C3)Br)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CC(=O)OCC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C20H21BrFNO4S/c21-17-7-6-16(19(22)13-17)14-27-20(24)12-15-4-8-18(9-5-15)28(25,26)23-10-2-1-3-11-23/h4-9,13H,1-3,10-12,14H2