(4-bromanyl-2-fluoranyl-phenyl)methyl 2-chloranyl-5-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl)methyl 2-chloranyl-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: (4-bromo-2-fluoro-phenyl)methyl 2-chloro-5-(1-piperidylsulfonyl)benzoate CAS Name: 2-chloro-5-(1-piperidinylsulfonyl)benzoic acid (4-bromo-2-fluorophenyl)methyl ester IUPAC Name: (4-bromo-2-fluorophenyl)methyl 2-chloro-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-chloro-5-piperidinosulfonyl-benzoic acid (4-bromo-2-fluoro-benzyl) ester Formula: C19H18BrClFNO4S MolecularWeight: 490.770923

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18BrClFNO4S/c20-14-5-4-13(18(22)10-14)12-27-19(24)16-11-15(6-7-17(16)21)28(25,26)23-8-2-1-3-9-23/h4-7,10-11H,1-3,8-9,12H2