1-[(3-bromophenyl)-(2-fluorophenyl)methyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(3-bromophenyl)-(2-fluorophenyl)methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(3-bromophenyl)-(2-fluorophenyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(3-bromophenyl)-(2-fluorophenyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(3-bromophenyl)-(2-fluorophenyl)methyl]piperidine-3-carboxylic acid Traditional Name: 1-[(3-bromophenyl)-(2-fluorophenyl)methyl]nipecotic acid Formula: C19H19BrFNO2 MolecularWeight: 392.262063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(C2=CC(=CC=C2)Br)C3=CC=CC=C3F)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(C2=CC(=CC=C2)Br)C3=CC=CC=C3F)C(=O)O

InChI

InChI=1S/C19H19BrFNO2/c20-15-7-3-5-13(11-15)18(16-8-1-2-9-17(16)21)22-10-4-6-14(12-22)19(23)24/h1-3,5,7-9,11,14,18H,4,6,10,12H2,(H,23,24)