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

Systemtic Name: tert-butyl 3-[2-[(5-bromanyl-2-fluoranyl-phenyl)methoxy]ethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[2-[(5-bromo-2-fluoro-phenyl)methoxy]ethyl]piperidine-1-carboxylate CAS Name: 3-[2-[(5-bromo-2-fluorophenyl)methoxy]ethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[2-[(5-bromo-2-fluorophenyl)methoxy]ethyl]piperidine-1-carboxylate Traditional Name: 3-[2-(5-bromo-2-fluoro-benzyl)oxyethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C19H27BrFNO3 MolecularWeight: 416.324983

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)CCOCC2=C(C=CC(=C2)Br)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)CCOCC2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C19H27BrFNO3/c1-19(2,3)25-18(23)22-9-4-5-14(12-22)8-10-24-13-15-11-16(20)6-7-17(15)21/h6-7,11,14H,4-5,8-10,12-13H2,1-3H3