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

Systemtic Name: 4-[4-[2-(4-bromanylphenoxy)ethoxy]phenyl]-3-(naphthalen-2-ylmethoxy)piperidine-1-carboxylic acid Openeye Name: 4-[4-[2-(4-bromophenoxy)ethoxy]phenyl]-3-(2-naphthylmethoxy)piperidine-1-carboxylic acid CAS Name: 4-[4-[2-(4-bromophenoxy)ethoxy]phenyl]-3-(2-naphthalenylmethoxy)-1-piperidinecarboxylic acid IUPAC Name: 4-[4-[2-(4-bromophenoxy)ethoxy]phenyl]-3-(naphthalen-2-ylmethoxy)piperidine-1-carboxylic acid Traditional Name: 4-[4-[2-(4-bromophenoxy)ethoxy]phenyl]-3-(2-naphthylmethoxy)piperidine-1-carboxylic acid Formula: C31H30BrNO5 MolecularWeight: 576.4776

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H30BrNO5/c32-26-9-13-28(14-10-26)37-18-17-36-27-11-7-24(8-12-27)29-15-16-33(31(34)35)20-30(29)38-21-22-5-6-23-3-1-2-4-25(23)19-22/h1-14,19,29-30H,15-18,20-21H2,(H,34,35)