tert-butyl 4-[3-[[4-(2-methoxyethoxycarbonyl)-2-nitro-phenyl]amino]phenyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-[[4-(2-methoxyethoxycarbonyl)-2-nitro-phenyl]amino]phenyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[3-[4-(2-methoxyethoxycarbonyl)-2-nitro-anilino]phenyl]piperazine-1-carboxylate CAS Name: 4-[3-[4-[2-methoxyethoxy(oxo)methyl]-2-nitroanilino]phenyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-[4-(2-methoxyethoxycarbonyl)-2-nitroanilino]phenyl]piperazine-1-carboxylate Traditional Name: 4-[3-[4-(2-methoxyethoxycarbonyl)-2-nitro-anilino]phenyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C25H32N4O7 MolecularWeight: 500.54418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC(=CC=C2)NC3=C(C=C(C=C3)C(=O)OCCOC)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC(=CC=C2)NC3=C(C=C(C=C3)C(=O)OCCOC)[N+](=O)[O-]

InChI

InChI=1S/C25H32N4O7/c1-25(2,3)36-24(31)28-12-10-27(11-13-28)20-7-5-6-19(17-20)26-21-9-8-18(16-22(21)29(32)33)23(30)35-15-14-34-4/h5-9,16-17,26H,10-15H2,1-4H3