tert-butyl 4-(4-nitrophenyl)carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(4-nitrophenyl)carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-(4-nitrobenzoyl)piperazine-1-carboxylate CAS Name: 4-[(4-nitrophenyl)-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(4-nitrobenzoyl)piperazine-1-carboxylate Traditional Name: 4-(4-nitrobenzoyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C16H21N3O5 MolecularWeight: 335.35504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N3O5/c1-16(2,3)24-15(21)18-10-8-17(9-11-18)14(20)12-4-6-13(7-5-12)19(22)23/h4-7H,8-11H2,1-3H3