tert-butyl 4-[2-fluoranyl-4-isocyano-5-(2-methoxyethoxy)phenyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-fluoranyl-4-isocyano-5-(2-methoxyethoxy)phenyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-fluoro-4-isocyano-5-(2-methoxyethoxy)phenyl]piperazine-1-carboxylate CAS Name: 4-[2-fluoro-4-isocyano-5-(2-methoxyethoxy)phenyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-fluoro-4-isocyano-5-(2-methoxyethoxy)phenyl]piperazine-1-carboxylate Traditional Name: 4-[2-fluoro-4-isocyano-5-(2-methoxyethoxy)phenyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C19H26FN3O4 MolecularWeight: 379.425843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=C(C=C(C(=C2)OCCOC)[N+]#[C-])F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=C(C=C(C(=C2)OCCOC)[N+]#[C-])F

InChI

InChI=1S/C19H26FN3O4/c1-19(2,3)27-18(24)23-8-6-22(7-9-23)16-13-17(26-11-10-25-5)15(21-4)12-14(16)20/h12-13H,6-11H2,1-3,5H3