(2-chloranyl-6-fluoranyl-phenyl)methyl 3-piperidin-1-ylsulfonylbenzoate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl 3-piperidin-1-ylsulfonylbenzoate Openeye Name: (2-chloro-6-fluoro-phenyl)methyl 3-(1-piperidylsulfonyl)benzoate CAS Name: 3-(1-piperidinylsulfonyl)benzoic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl 3-piperidin-1-ylsulfonylbenzoate Traditional Name: 3-piperidinosulfonylbenzoic acid (2-chloro-6-fluoro-benzyl) ester Formula: C19H19ClFNO4S MolecularWeight: 411.874863

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=C(C=CC=C3Cl)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C19H19ClFNO4S/c20-17-8-5-9-18(21)16(17)13-26-19(23)14-6-4-7-15(12-14)27(24,25)22-10-2-1-3-11-22/h4-9,12H,1-3,10-11,13H2