tert-butyl 4-[4-[(2-aminocarbonyl-3-fluoranyl-phenoxy)methyl]phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[(2-aminocarbonyl-3-fluoranyl-phenoxy)methyl]phenyl]carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-[(2-carbamoyl-3-fluoro-phenoxy)methyl]benzoyl]piperazine-1-carboxylate CAS Name: 4-[[4-[(2-carbamoyl-3-fluorophenoxy)methyl]phenyl]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[(2-carbamoyl-3-fluorophenoxy)methyl]benzoyl]piperazine-1-carboxylate Traditional Name: 4-[4-[(2-carbamoyl-3-fluoro-phenoxy)methyl]benzoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C24H28FN3O5 MolecularWeight: 457.494623

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)COC3=C(C(=CC=C3)F)C(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)COC3=C(C(=CC=C3)F)C(=O)N

InChI

InChI=1S/C24H28FN3O5/c1-24(2,3)33-23(31)28-13-11-27(12-14-28)22(30)17-9-7-16(8-10-17)15-32-19-6-4-5-18(25)20(19)21(26)29/h4-10H,11-15H2,1-3H3,(H2,26,29)