tert-butyl 4-[2-fluoranyl-4-(oxiran-2-ylmethoxycarbonylamino)phenyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-fluoranyl-4-(oxiran-2-ylmethoxycarbonylamino)phenyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-fluoro-4-(oxiran-2-ylmethoxycarbonylamino)phenyl]piperazine-1-carboxylate CAS Name: 4-[2-fluoro-4-[[2-oxiranylmethoxy(oxo)methyl]amino]phenyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-fluoro-4-(oxiran-2-ylmethoxycarbonylamino)phenyl]piperazine-1-carboxylate Traditional Name: 4-[2-fluoro-4-(glycidoxycarbonylamino)phenyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C19H26FN3O5 MolecularWeight: 395.425243

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)OCC3CO3)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)OCC3CO3)F

InChI

InChI=1S/C19H26FN3O5/c1-19(2,3)28-18(25)23-8-6-22(7-9-23)16-5-4-13(10-15(16)20)21-17(24)27-12-14-11-26-14/h4-5,10,14H,6-9,11-12H2,1-3H3,(H,21,24)