tert-butyl 2-[3-[(5-bromanyl-2-fluoranyl-phenyl)methoxy]propyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 2-[3-[(5-bromanyl-2-fluoranyl-phenyl)methoxy]propyl]piperidine-1-carboxylate Openeye Name: tert-butyl 2-[3-[(5-bromo-2-fluoro-phenyl)methoxy]propyl]piperidine-1-carboxylate CAS Name: 2-[3-[(5-bromo-2-fluorophenyl)methoxy]propyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[3-[(5-bromo-2-fluorophenyl)methoxy]propyl]piperidine-1-carboxylate Traditional Name: 2-[3-(5-bromo-2-fluoro-benzyl)oxypropyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C20H29BrFNO3 MolecularWeight: 430.351563

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCCC1CCCOCC2=C(C=CC(=C2)Br)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCCC1CCCOCC2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C20H29BrFNO3/c1-20(2,3)26-19(24)23-11-5-4-7-17(23)8-6-12-25-14-15-13-16(21)9-10-18(15)22/h9-10,13,17H,4-8,11-12,14H2,1-3H3