tert-butyl 4-(3-cyano-4-fluoranyl-phenyl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(3-cyano-4-fluoranyl-phenyl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(3-cyano-4-fluoro-phenyl)piperazine-1-carboxylate CAS Name: 4-(3-cyano-4-fluorophenyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(3-cyano-4-fluorophenyl)piperazine-1-carboxylate Traditional Name: 4-(3-cyano-4-fluoro-phenyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C16H20FN3O2 MolecularWeight: 305.347303

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20FN3O2/c1-16(2,3)22-15(21)20-8-6-19(7-9-20)13-4-5-14(17)12(10-13)11-18/h4-5,10H,6-9H2,1-3H3