tert-butyl 4-[4-(2-methoxyethylamino)-3-nitro-phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(2-methoxyethylamino)-3-nitro-phenyl]carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-(2-methoxyethylamino)-3-nitro-benzoyl]piperazine-1-carboxylate CAS Name: 4-[[4-(2-methoxyethylamino)-3-nitrophenyl]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(2-methoxyethylamino)-3-nitrobenzoyl]piperazine-1-carboxylate Traditional Name: 4-[4-(2-methoxyethylamino)-3-nitro-benzoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C19H28N4O6 MolecularWeight: 408.44882

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H28N4O6/c1-19(2,3)29-18(25)22-10-8-21(9-11-22)17(24)14-5-6-15(20-7-12-28-4)16(13-14)23(26)27/h5-6,13,20H,7-12H2,1-4H3