tert-butyl 4-(3-methoxycarbonyl-5-nitro-phenyl)carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(3-methoxycarbonyl-5-nitro-phenyl)carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-(3-methoxycarbonyl-5-nitro-benzoyl)piperazine-1-carboxylate CAS Name: 4-[(3-methoxycarbonyl-5-nitrophenyl)-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(3-methoxycarbonyl-5-nitrobenzoyl)piperazine-1-carboxylate Traditional Name: 4-(3-carbomethoxy-5-nitro-benzoyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C18H23N3O7 MolecularWeight: 393.39112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N3O7/c1-18(2,3)28-17(24)20-7-5-19(6-8-20)15(22)12-9-13(16(23)27-4)11-14(10-12)21(25)26/h9-11H,5-8H2,1-4H3