tert-butyl 4-[3-(4-fluoranylphenoxy)propyl]-2-oxidanyl-piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-(4-fluoranylphenoxy)propyl]-2-oxidanyl-piperazine-1-carboxylate Openeye Name: tert-butyl 4-[3-(4-fluorophenoxy)propyl]-2-hydroxy-piperazine-1-carboxylate CAS Name: 4-[3-(4-fluorophenoxy)propyl]-2-hydroxy-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-(4-fluorophenoxy)propyl]-2-hydroxypiperazine-1-carboxylate Traditional Name: 4-[3-(4-fluorophenoxy)propyl]-2-hydroxy-piperazine-1-carboxylic acid tert-butyl ester Formula: C18H27FN2O4 MolecularWeight: 354.416383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1O)CCCOC2=CC=C(C=C2)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1O)CCCOC2=CC=C(C=C2)F

InChI

InChI=1S/C18H27FN2O4/c1-18(2,3)25-17(23)21-11-10-20(13-16(21)22)9-4-12-24-15-7-5-14(19)6-8-15/h5-8,16,22H,4,9-13H2,1-3H3