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

Systemtic Name: tert-butyl 3-[3-[(5-bromanyl-2-fluoranyl-phenyl)methoxy]propyl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[3-[(5-bromo-2-fluoro-phenyl)methoxy]propyl]piperidine-1-carboxylate CAS Name: 3-[3-[(5-bromo-2-fluorophenyl)methoxy]propyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[3-[(5-bromo-2-fluorophenyl)methoxy]propyl]piperidine-1-carboxylate Traditional Name: 3-[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)N1CCCC(C1)CCCOCC2=C(C=CC(=C2)Br)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)CCCOCC2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C20H29BrFNO3/c1-20(2,3)26-19(24)23-10-4-6-15(13-23)7-5-11-25-14-16-12-17(21)8-9-18(16)22/h8-9,12,15H,4-7,10-11,13-14H2,1-3H3