(2-chloranyl-4-cyano-phenyl) 1-(4-fluorophenyl)carbonylpiperidine-3-carboxylate

Systemtic Name: (2-chloranyl-4-cyano-phenyl) 1-(4-fluorophenyl)carbonylpiperidine-3-carboxylate Openeye Name: (2-chloro-4-cyano-phenyl) 1-(4-fluorobenzoyl)piperidine-3-carboxylate CAS Name: 1-[(4-fluorophenyl)-oxomethyl]-3-piperidinecarboxylic acid (2-chloro-4-cyanophenyl) ester IUPAC Name: (2-chloro-4-cyanophenyl) 1-(4-fluorobenzoyl)piperidine-3-carboxylate Traditional Name: 1-(4-fluorobenzoyl)nipecotic acid (2-chloro-4-cyano-phenyl) ester Formula: C20H16ClFN2O3 MolecularWeight: 386.804043

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC=C(C=C2)F)C(=O)OC3=C(C=C(C=C3)C#N)Cl

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC=C(C=C2)F)C(=O)OC3=C(C=C(C=C3)C#N)Cl

InChI

InChI=1S/C20H16ClFN2O3/c21-17-10-13(11-23)3-8-18(17)27-20(26)15-2-1-9-24(12-15)19(25)14-4-6-16(22)7-5-14/h3-8,10,15H,1-2,9,12H2