1-[2-(4-bromanylphenoxy)ethyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[2-(4-bromanylphenoxy)ethyl]piperidine-3-carboxylic acid Openeye Name: 1-[2-(4-bromophenoxy)ethyl]piperidine-3-carboxylic acid CAS Name: 1-[2-(4-bromophenoxy)ethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[2-(4-bromophenoxy)ethyl]piperidine-3-carboxylic acid Traditional Name: 1-[2-(4-bromophenoxy)ethyl]nipecotic acid Formula: C14H18BrNO3 MolecularWeight: 328.20162

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCOC2=CC=C(C=C2)Br)C(=O)O

Isomeric SMILES

C1CC(CN(C1)CCOC2=CC=C(C=C2)Br)C(=O)O

InChI

InChI=1S/C14H18BrNO3/c15-12-3-5-13(6-4-12)19-9-8-16-7-1-2-11(10-16)14(17)18/h3-6,11H,1-2,7-10H2,(H,17,18)