(2-bromanyl-4-fluoranyl-phenyl) 1-(4-cyanophenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: (2-bromanyl-4-fluoranyl-phenyl) 1-(4-cyanophenyl)sulfonylpiperidine-4-carboxylate Openeye Name: (2-bromo-4-fluoro-phenyl) 1-(4-cyanophenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(4-cyanophenyl)sulfonyl-4-piperidinecarboxylic acid (2-bromo-4-fluorophenyl) ester IUPAC Name: (2-bromo-4-fluorophenyl) 1-(4-cyanophenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(4-cyanophenyl)sulfonylisonipecotic acid (2-bromo-4-fluoro-phenyl) ester Formula: C19H16BrFN2O4S MolecularWeight: 467.308743

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OC2=C(C=C(C=C2)F)Br)S(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1CN(CCC1C(=O)OC2=C(C=C(C=C2)F)Br)S(=O)(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H16BrFN2O4S/c20-17-11-15(21)3-6-18(17)27-19(24)14-7-9-23(10-8-14)28(25,26)16-4-1-13(12-22)2-5-16/h1-6,11,14H,7-10H2