ethyl 5-(4,5-dimethoxy-2-nitro-phenyl)carbonyl-2-(1-imidazol-1-ylcarbonyloxy-2-methyl-propyl)-1,2,3-triazole-4-carboxylate

Systemtic Name: ethyl 5-(4,5-dimethoxy-2-nitro-phenyl)carbonyl-2-(1-imidazol-1-ylcarbonyloxy-2-methyl-propyl)-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 5-(4,5-dimethoxy-2-nitro-benzoyl)-2-[1-(imidazole-1-carbonyloxy)-2-methyl-propyl]triazole-4-carboxylate CAS Name: 5-[(4,5-dimethoxy-2-nitrophenyl)-oxomethyl]-2-[1-[1-imidazolyl(oxo)methoxy]-2-methylpropyl]-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4,5-dimethoxy-2-nitrobenzoyl)-2-[1-(imidazole-1-carbonyloxy)-2-methylpropyl]triazole-4-carboxylate Traditional Name: 5-(4,5-dimethoxy-2-nitro-benzoyl)-2-[1-(imidazole-1-carbonyloxy)-2-methyl-propyl]triazole-4-carboxylic acid ethyl ester Formula: C22H24N6O9 MolecularWeight: 516.46076

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(N=C1C(=O)C2=CC(=C(C=C2[N+](=O)[O-])OC)OC)C(C(C)C)OC(=O)N3C=CN=C3

Isomeric SMILES

CCOC(=O)C1=NN(N=C1C(=O)C2=CC(=C(C=C2[N+](=O)[O-])OC)OC)C(C(C)C)OC(=O)N3C=CN=C3

InChI

InChI=1S/C22H24N6O9/c1-6-36-21(30)18-17(19(29)13-9-15(34-4)16(35-5)10-14(13)28(32)33)24-27(25-18)20(12(2)3)37-22(31)26-8-7-23-11-26/h7-12,20H,6H2,1-5H3