(2-chloranyl-4-fluoranyl-phenyl)methyl 1-(4-fluorophenyl)sulfonylpiperidine-3-carboxylate

Systemtic Name: (2-chloranyl-4-fluoranyl-phenyl)methyl 1-(4-fluorophenyl)sulfonylpiperidine-3-carboxylate Openeye Name: (2-chloro-4-fluoro-phenyl)methyl 1-(4-fluorophenyl)sulfonylpiperidine-3-carboxylate CAS Name: 1-(4-fluorophenyl)sulfonyl-3-piperidinecarboxylic acid (2-chloro-4-fluorophenyl)methyl ester IUPAC Name: (2-chloro-4-fluorophenyl)methyl 1-(4-fluorophenyl)sulfonylpiperidine-3-carboxylate Traditional Name: 1-(4-fluorophenyl)sulfonylnipecotic acid (2-chloro-4-fluoro-benzyl) ester Formula: C19H18ClF2NO4S MolecularWeight: 429.865326

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)OCC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)OCC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C19H18ClF2NO4S/c20-18-10-16(22)4-3-14(18)12-27-19(24)13-2-1-9-23(11-13)28(25,26)17-7-5-15(21)6-8-17/h3-8,10,13H,1-2,9,11-12H2