tert-butyl 4-(5-nitropyridin-2-yl)-4-piperazin-1-yl-2-pyrrolidin-1-ylcarbonyl-pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 4-(5-nitropyridin-2-yl)-4-piperazin-1-yl-2-pyrrolidin-1-ylcarbonyl-pyrrolidine-1-carboxylate Openeye Name: tert-butyl 4-(5-nitro-2-pyridyl)-4-piperazin-1-yl-2-(pyrrolidine-1-carbonyl)pyrrolidine-1-carboxylate CAS Name: 4-(5-nitro-2-pyridinyl)-2-[oxo(1-pyrrolidinyl)methyl]-4-(1-piperazinyl)-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(5-nitropyridin-2-yl)-4-piperazin-1-yl-2-(pyrrolidine-1-carbonyl)pyrrolidine-1-carboxylate Traditional Name: 4-(5-nitro-2-pyridyl)-4-piperazino-2-(pyrrolidine-1-carbonyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C23H34N6O5 MolecularWeight: 474.55326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCCC2)(C3=NC=C(C=C3)[N+](=O)[O-])N4CCNCC4

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCCC2)(C3=NC=C(C=C3)[N+](=O)[O-])N4CCNCC4

InChI

InChI=1S/C23H34N6O5/c1-22(2,3)34-21(31)28-16-23(27-12-8-24-9-13-27,19-7-6-17(15-25-19)29(32)33)14-18(28)20(30)26-10-4-5-11-26/h6-7,15,18,24H,4-5,8-14,16H2,1-3H3