O4-tert-butyl O1-(4-nitrophenyl) piperazine-1,4-dicarboxylate

Systemtic Name: O4-tert-butyl O1-(4-nitrophenyl) piperazine-1,4-dicarboxylate Openeye Name: O4-tert-butyl O1-(4-nitrophenyl) piperazine-1,4-dicarboxylate CAS Name: piperazine-1,4-dicarboxylic acid O4-tert-butyl ester O1-(4-nitrophenyl) ester IUPAC Name: 4-O-tert-butyl 1-O-(4-nitrophenyl) piperazine-1,4-dicarboxylate Traditional Name: piperazine-1,4-dicarboxylic acid O4-tert-butyl ester O1-(4-nitrophenyl) ester Formula: C16H21N3O6 MolecularWeight: 351.35444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H21N3O6/c1-16(2,3)25-15(21)18-10-8-17(9-11-18)14(20)24-13-6-4-12(5-7-13)19(22)23/h4-7H,8-11H2,1-3H3