tert-butyl 4-[3-(4-cyano-3-fluoranyl-phenoxy)propyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-(4-cyano-3-fluoranyl-phenoxy)propyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[3-(4-cyano-3-fluoro-phenoxy)propyl]piperazine-1-carboxylate CAS Name: 4-[3-(4-cyano-3-fluorophenoxy)propyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-(4-cyano-3-fluorophenoxy)propyl]piperazine-1-carboxylate Traditional Name: 4-[3-(4-cyano-3-fluoro-phenoxy)propyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C19H26FN3O3 MolecularWeight: 363.426443

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)CCCOC2=CC(=C(C=C2)C#N)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)CCCOC2=CC(=C(C=C2)C#N)F

InChI

InChI=1S/C19H26FN3O3/c1-19(2,3)26-18(24)23-10-8-22(9-11-23)7-4-12-25-16-6-5-15(14-21)17(20)13-16/h5-6,13H,4,7-12H2,1-3H3