1-[2-[tris(4-fluorophenyl)methoxy]ethyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[2-[tris(4-fluorophenyl)methoxy]ethyl]piperidine-3-carboxylic acid Openeye Name: 1-[2-[tris(4-fluorophenyl)methoxy]ethyl]piperidine-3-carboxylic acid CAS Name: 1-[2-[tris(4-fluorophenyl)methoxy]ethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[2-[tris(4-fluorophenyl)methoxy]ethyl]piperidine-3-carboxylic acid Traditional Name: 1-[2-[tris(4-fluorophenyl)methoxy]ethyl]nipecotic acid Formula: C27H26F3NO3 MolecularWeight: 469.49545

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCOC(C2=CC=C(C=C2)F)(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F)C(=O)O

Isomeric SMILES

C1CC(CN(C1)CCOC(C2=CC=C(C=C2)F)(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F)C(=O)O

InChI

InChI=1S/C27H26F3NO3/c28-23-9-3-20(4-10-23)27(21-5-11-24(29)12-6-21,22-7-13-25(30)14-8-22)34-17-16-31-15-1-2-19(18-31)26(32)33/h3-14,19H,1-2,15-18H2,(H,32,33)