2-(4-bromanylphenoxy)ethyl 1-(4-fluorophenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: 2-(4-bromanylphenoxy)ethyl 1-(4-fluorophenyl)carbonylpiperidine-4-carboxylate Openeye Name: 2-(4-bromophenoxy)ethyl 1-(4-fluorobenzoyl)piperidine-4-carboxylate CAS Name: 1-[(4-fluorophenyl)-oxomethyl]-4-piperidinecarboxylic acid 2-(4-bromophenoxy)ethyl ester IUPAC Name: 2-(4-bromophenoxy)ethyl 1-(4-fluorobenzoyl)piperidine-4-carboxylate Traditional Name: 1-(4-fluorobenzoyl)isonipecotic acid 2-(4-bromophenoxy)ethyl ester Formula: C21H21BrFNO4 MolecularWeight: 450.298143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCCOC2=CC=C(C=C2)Br)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCC1C(=O)OCCOC2=CC=C(C=C2)Br)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H21BrFNO4/c22-17-3-7-19(8-4-17)27-13-14-28-21(26)16-9-11-24(12-10-16)20(25)15-1-5-18(23)6-2-15/h1-8,16H,9-14H2