tert-butyl 4-[4-(dimethylamino)-3-nitro-phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(dimethylamino)-3-nitro-phenyl]carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-(dimethylamino)-3-nitro-benzoyl]piperazine-1-carboxylate CAS Name: 4-[[4-(dimethylamino)-3-nitrophenyl]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(dimethylamino)-3-nitrobenzoyl]piperazine-1-carboxylate Traditional Name: 4-[4-(dimethylamino)-3-nitro-benzoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C18H26N4O5 MolecularWeight: 378.42284

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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(C)C)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C18H26N4O5/c1-18(2,3)27-17(24)21-10-8-20(9-11-21)16(23)13-6-7-14(19(4)5)15(12-13)22(25)26/h6-7,12H,8-11H2,1-5H3