(2-chloranyl-4-fluoranyl-phenyl) 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate

Systemtic Name: (2-chloranyl-4-fluoranyl-phenyl) 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Openeye Name: (2-chloro-4-fluoro-phenyl) 1-(2-thienylsulfonyl)piperidine-4-carboxylate CAS Name: 1-thiophen-2-ylsulfonyl-4-piperidinecarboxylic acid (2-chloro-4-fluorophenyl) ester IUPAC Name: (2-chloro-4-fluorophenyl) 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Traditional Name: 1-(2-thienylsulfonyl)isonipecotic acid (2-chloro-4-fluoro-phenyl) ester Formula: C16H15ClFNO4S2 MolecularWeight: 403.876003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OC2=C(C=C(C=C2)F)Cl)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CCC1C(=O)OC2=C(C=C(C=C2)F)Cl)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C16H15ClFNO4S2/c17-13-10-12(18)3-4-14(13)23-16(20)11-5-7-19(8-6-11)25(21,22)15-2-1-9-24-15/h1-4,9-11H,5-8H2