1-[2,5-bis(fluoranyl)-4-methoxy-phenyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[2,5-bis(fluoranyl)-4-methoxy-phenyl]piperidine-4-carboxylic acid Openeye Name: 1-(2,5-difluoro-4-methoxy-phenyl)piperidine-4-carboxylic acid CAS Name: 1-(2,5-difluoro-4-methoxyphenyl)-4-piperidinecarboxylic acid IUPAC Name: 1-(2,5-difluoro-4-methoxyphenyl)piperidine-4-carboxylic acid Traditional Name: 1-(2,5-difluoro-4-methoxy-phenyl)isonipecotic acid Formula: C13H15F2NO3 MolecularWeight: 271.259906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)F)N2CCC(CC2)C(=O)O)F

Isomeric SMILES

COC1=C(C=C(C(=C1)F)N2CCC(CC2)C(=O)O)F

InChI

InChI=1S/C13H15F2NO3/c1-19-12-7-9(14)11(6-10(12)15)16-4-2-8(3-5-16)13(17)18/h6-8H,2-5H2,1H3,(H,17,18)