ethyl 5-(4,5-dimethoxy-2-nitro-phenyl)carbonyl-2-(2-methylpropoxycarbonyloxymethyl)-1,2,3-triazole-4-carboxylate

Systemtic Name: ethyl 5-(4,5-dimethoxy-2-nitro-phenyl)carbonyl-2-(2-methylpropoxycarbonyloxymethyl)-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 5-(4,5-dimethoxy-2-nitro-benzoyl)-2-(isobutoxycarbonyloxymethyl)triazole-4-carboxylate CAS Name: 5-[(4,5-dimethoxy-2-nitrophenyl)-oxomethyl]-2-[[2-methylpropoxy(oxo)methoxy]methyl]-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4,5-dimethoxy-2-nitrobenzoyl)-2-(2-methylpropoxycarbonyloxymethyl)triazole-4-carboxylate Traditional Name: 5-(4,5-dimethoxy-2-nitro-benzoyl)-2-(isobutoxycarbonyloxymethyl)triazole-4-carboxylic acid ethyl ester Formula: C20H24N4O10 MolecularWeight: 480.42536

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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)COC(=O)OCC(C)C

Isomeric SMILES

CCOC(=O)C1=NN(N=C1C(=O)C2=CC(=C(C=C2[N+](=O)[O-])OC)OC)COC(=O)OCC(C)C

InChI

InChI=1S/C20H24N4O10/c1-6-32-19(26)17-16(21-23(22-17)10-34-20(27)33-9-11(2)3)18(25)12-7-14(30-4)15(31-5)8-13(12)24(28)29/h7-8,11H,6,9-10H2,1-5H3