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

Systemtic Name: tert-butyl 4-[2-(2-nitrophenyl)ethanoyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-(2-nitrophenyl)acetyl]piperazine-1-carboxylate CAS Name: 4-[2-(2-nitrophenyl)-1-oxoethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(2-nitrophenyl)acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-(2-nitrophenyl)acetyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C17H23N3O5 MolecularWeight: 349.38162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)CC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C17H23N3O5/c1-17(2,3)25-16(22)19-10-8-18(9-11-19)15(21)12-13-6-4-5-7-14(13)20(23)24/h4-7H,8-12H2,1-3H3