tert-butyl 4-[2-(4-nitrophenyl)ethyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-(4-nitrophenyl)ethyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-(4-nitrophenyl)ethyl]piperazine-1-carboxylate CAS Name: 4-[2-(4-nitrophenyl)ethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(4-nitrophenyl)ethyl]piperazine-1-carboxylate Traditional Name: 4-[2-(4-nitrophenyl)ethyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C17H25N3O4 MolecularWeight: 335.3981

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)CCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)CCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H25N3O4/c1-17(2,3)24-16(21)19-12-10-18(11-13-19)9-8-14-4-6-15(7-5-14)20(22)23/h4-7H,8-13H2,1-3H3