tert-butyl 4-(2-methanoyl-4-nitro-phenyl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(2-methanoyl-4-nitro-phenyl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(2-formyl-4-nitro-phenyl)piperazine-1-carboxylate CAS Name: 4-(2-formyl-4-nitrophenyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-formyl-4-nitrophenyl)piperazine-1-carboxylate Traditional Name: 4-(2-formyl-4-nitro-phenyl)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)C2=C(C=C(C=C2)[N+](=O)[O-])C=O

Isomeric SMILES

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

InChI

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