(4,5-dimethoxy-2-nitro-phenyl)methyl 2-(5-tert-butyl-2-methyl-pyrazol-3-yl)carbonylpyrazolidine-1-carboxylate

Systemtic Name: (4,5-dimethoxy-2-nitro-phenyl)methyl 2-(5-tert-butyl-2-methyl-pyrazol-3-yl)carbonylpyrazolidine-1-carboxylate Openeye Name: (4,5-dimethoxy-2-nitro-phenyl)methyl 2-(5-tert-butyl-2-methyl-pyrazole-3-carbonyl)pyrazolidine-1-carboxylate CAS Name: 2-[(5-tert-butyl-2-methyl-3-pyrazolyl)-oxomethyl]-1-pyrazolidinecarboxylic acid (4,5-dimethoxy-2-nitrophenyl)methyl ester IUPAC Name: (4,5-dimethoxy-2-nitrophenyl)methyl 2-(5-tert-butyl-2-methylpyrazole-3-carbonyl)pyrazolidine-1-carboxylate Traditional Name: 2-(5-tert-butyl-2-methyl-pyrazole-3-carbonyl)pyrazolidine-1-carboxylic acid (4,5-dimethoxy-2-nitro-benzyl) ester Formula: C22H29N5O7 MolecularWeight: 475.49496

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)C(=O)N2CCCN2C(=O)OCC3=CC(=C(C=C3[N+](=O)[O-])OC)OC)C

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)C(=O)N2CCCN2C(=O)OCC3=CC(=C(C=C3[N+](=O)[O-])OC)OC)C

InChI

InChI=1S/C22H29N5O7/c1-22(2,3)19-12-16(24(4)23-19)20(28)25-8-7-9-26(25)21(29)34-13-14-10-17(32-5)18(33-6)11-15(14)27(30)31/h10-12H,7-9,13H2,1-6H3