tert-butyl 2-cyano-4-[(5-nitropyridin-2-yl)amino]-2-pyrrolidin-2-ylcarbonyl-pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-cyano-4-[(5-nitropyridin-2-yl)amino]-2-pyrrolidin-2-ylcarbonyl-pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-cyano-4-[(5-nitro-2-pyridyl)amino]-2-(pyrrolidine-2-carbonyl)pyrrolidine-1-carboxylate CAS Name: 2-cyano-4-[(5-nitro-2-pyridinyl)amino]-2-[oxo(2-pyrrolidinyl)methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-cyano-4-[(5-nitropyridin-2-yl)amino]-2-(pyrrolidine-2-carbonyl)pyrrolidine-1-carboxylate Traditional Name: 2-cyano-4-[(5-nitro-2-pyridyl)amino]-2-prolyl-pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C20H26N6O5 MolecularWeight: 430.45764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1(C#N)C(=O)C2CCCN2)NC3=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1(C#N)C(=O)C2CCCN2)NC3=NC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H26N6O5/c1-19(2,3)31-18(28)25-11-13(24-16-7-6-14(10-23-16)26(29)30)9-20(25,12-21)17(27)15-5-4-8-22-15/h6-7,10,13,15,22H,4-5,8-9,11H2,1-3H3,(H,23,24)