O4-tert-butyl O1-(3-fluoranyl-4-methanoyl-phenyl) piperazine-1,4-dicarboxylate

Systemtic Name: O4-tert-butyl O1-(3-fluoranyl-4-methanoyl-phenyl) piperazine-1,4-dicarboxylate Openeye Name: O4-tert-butyl O1-(3-fluoro-4-formyl-phenyl) piperazine-1,4-dicarboxylate CAS Name: piperazine-1,4-dicarboxylic acid O4-tert-butyl ester O1-(3-fluoro-4-formylphenyl) ester IUPAC Name: 4-O-tert-butyl 1-O-(3-fluoro-4-formylphenyl) piperazine-1,4-dicarboxylate Traditional Name: piperazine-1,4-dicarboxylic acid O4-tert-butyl ester O1-(3-fluoro-4-formyl-phenyl) ester Formula: C17H21FN2O5 MolecularWeight: 352.357443

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)OC2=CC(=C(C=C2)C=O)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)OC2=CC(=C(C=C2)C=O)F

InChI

InChI=1S/C17H21FN2O5/c1-17(2,3)25-16(23)20-8-6-19(7-9-20)15(22)24-13-5-4-12(11-21)14(18)10-13/h4-5,10-11H,6-9H2,1-3H3