tert-butyl 4-[[3-fluoranyl-4-[(4-fluorophenyl)iminomethyl]phenoxy]methyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[[3-fluoranyl-4-[(4-fluorophenyl)iminomethyl]phenoxy]methyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[[3-fluoro-4-[(4-fluorophenyl)iminomethyl]phenoxy]methyl]piperazine-1-carboxylate CAS Name: 4-[[3-fluoro-4-[(4-fluorophenyl)iminomethyl]phenoxy]methyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[3-fluoro-4-[(4-fluorophenyl)iminomethyl]phenoxy]methyl]piperazine-1-carboxylate Traditional Name: 4-[[3-fluoro-4-[(4-fluorophenyl)iminomethyl]phenoxy]methyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C23H27F2N3O3 MolecularWeight: 431.475586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)COC2=CC(=C(C=C2)C=NC3=CC=C(C=C3)F)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)COC2=CC(=C(C=C2)C=NC3=CC=C(C=C3)F)F

InChI

InChI=1S/C23H27F2N3O3/c1-23(2,3)31-22(29)28-12-10-27(11-13-28)16-30-20-9-4-17(21(25)14-20)15-26-19-7-5-18(24)6-8-19/h4-9,14-15H,10-13,16H2,1-3H3