ethyl 5-(4,5-dimethoxy-2-nitro-phenyl)carbonyl-1-[(4-methoxyphenyl)methyl]-1,2,3-triazole-4-carboxylate

Systemtic Name: ethyl 5-(4,5-dimethoxy-2-nitro-phenyl)carbonyl-1-[(4-methoxyphenyl)methyl]-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 5-(4,5-dimethoxy-2-nitro-benzoyl)-1-[(4-methoxyphenyl)methyl]triazole-4-carboxylate CAS Name: 5-[(4,5-dimethoxy-2-nitrophenyl)-oxomethyl]-1-[(4-methoxyphenyl)methyl]-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4,5-dimethoxy-2-nitrobenzoyl)-1-[(4-methoxyphenyl)methyl]triazole-4-carboxylate Traditional Name: 5-(4,5-dimethoxy-2-nitro-benzoyl)-1-p-anisyl-triazole-4-carboxylic acid ethyl ester Formula: C22H22N4O8 MolecularWeight: 470.43208

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=N1)CC2=CC=C(C=C2)OC)C(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC

Isomeric SMILES

CCOC(=O)C1=C(N(N=N1)CC2=CC=C(C=C2)OC)C(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC

InChI

InChI=1S/C22H22N4O8/c1-5-34-22(28)19-20(25(24-23-19)12-13-6-8-14(31-2)9-7-13)21(27)15-10-17(32-3)18(33-4)11-16(15)26(29)30/h6-11H,5,12H2,1-4H3