1-[[2,4-bis(fluoranyl)phenyl]-quinolin-2-yl-methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[[2,4-bis(fluoranyl)phenyl]-quinolin-2-yl-methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(2,4-difluorophenyl)-(2-quinolyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(2,4-difluorophenyl)-(2-quinolinyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(2,4-difluorophenyl)-quinolin-2-ylmethyl]piperidine-2-carboxylic acid Traditional Name: 1-[(2,4-difluorophenyl)-(2-quinolyl)methyl]pipecolinic acid Formula: C22H20F2N2O2 MolecularWeight: 382.403206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)C(C2=C(C=C(C=C2)F)F)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

C1CCN(C(C1)C(=O)O)C(C2=C(C=C(C=C2)F)F)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H20F2N2O2/c23-15-9-10-16(17(24)13-15)21(26-12-4-3-7-20(26)22(27)28)19-11-8-14-5-1-2-6-18(14)25-19/h1-2,5-6,8-11,13,20-21H,3-4,7,12H2,(H,27,28)