1-[2-(2-bromanyl-4-chloranyl-phenoxy)ethyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[2-(2-bromanyl-4-chloranyl-phenoxy)ethyl]piperidine-3-carboxylic acid Openeye Name: 1-[2-(2-bromo-4-chloro-phenoxy)ethyl]piperidine-3-carboxylic acid CAS Name: 1-[2-(2-bromo-4-chlorophenoxy)ethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[2-(2-bromo-4-chlorophenoxy)ethyl]piperidine-3-carboxylic acid Traditional Name: 1-[2-(2-bromo-4-chloro-phenoxy)ethyl]nipecotic acid Formula: C14H17BrClNO3 MolecularWeight: 362.64668

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17BrClNO3/c15-12-8-11(16)3-4-13(12)20-7-6-17-5-1-2-10(9-17)14(18)19/h3-4,8,10H,1-2,5-7,9H2,(H,18,19)