ethyl 4-[3-(4-ethoxycarbonylpiperazin-1-yl)carbonyl-5-nitro-phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-(4-ethoxycarbonylpiperazin-1-yl)carbonyl-5-nitro-phenyl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[3-(4-ethoxycarbonylpiperazine-1-carbonyl)-5-nitro-benzoyl]piperazine-1-carboxylate CAS Name: 4-[[3-[(4-ethoxycarbonyl-1-piperazinyl)-oxomethyl]-5-nitrophenyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(4-ethoxycarbonylpiperazine-1-carbonyl)-5-nitrobenzoyl]piperazine-1-carboxylate Traditional Name: 4-[3-(4-carbethoxypiperazine-1-carbonyl)-5-nitro-benzoyl]piperazine-1-carboxylic acid ethyl ester Formula: C22H29N5O8 MolecularWeight: 491.49436

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)N3CCN(CC3)C(=O)OCC

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)N3CCN(CC3)C(=O)OCC

InChI

InChI=1S/C22H29N5O8/c1-3-34-21(30)25-9-5-23(6-10-25)19(28)16-13-17(15-18(14-16)27(32)33)20(29)24-7-11-26(12-8-24)22(31)35-4-2/h13-15H,3-12H2,1-2H3