3-(naphthalen-2-ylmethoxy)-4-[4-(2-phenoxyethoxy)phenyl]piperidine-1-carboxylic acid

Systemtic Name: 3-(naphthalen-2-ylmethoxy)-4-[4-(2-phenoxyethoxy)phenyl]piperidine-1-carboxylic acid Openeye Name: 3-(2-naphthylmethoxy)-4-[4-(2-phenoxyethoxy)phenyl]piperidine-1-carboxylic acid CAS Name: 3-(2-naphthalenylmethoxy)-4-[4-(2-phenoxyethoxy)phenyl]-1-piperidinecarboxylic acid IUPAC Name: 3-(naphthalen-2-ylmethoxy)-4-[4-(2-phenoxyethoxy)phenyl]piperidine-1-carboxylic acid Traditional Name: 3-(2-naphthylmethoxy)-4-[4-(2-phenoxyethoxy)phenyl]piperidine-1-carboxylic acid Formula: C31H31NO5 MolecularWeight: 497.58154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(C1C2=CC=C(C=C2)OCCOC3=CC=CC=C3)OCC4=CC5=CC=CC=C5C=C4)C(=O)O

Isomeric SMILES

C1CN(CC(C1C2=CC=C(C=C2)OCCOC3=CC=CC=C3)OCC4=CC5=CC=CC=C5C=C4)C(=O)O

InChI

InChI=1S/C31H31NO5/c33-31(34)32-17-16-29(30(21-32)37-22-23-10-11-24-6-4-5-7-26(24)20-23)25-12-14-28(15-13-25)36-19-18-35-27-8-2-1-3-9-27/h1-15,20,29-30H,16-19,21-22H2,(H,33,34)