hexoxycarbonyloxymethyl 5-(4,5-dimethoxy-2-nitro-phenyl)carbonyl-2H-1,2,3-triazole-4-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)OCOC(=O)C1=NNN=C1C(=O)C2=CC(=C(C=C2[N+](=O)[O-])OC)OC

Isomeric SMILES

CCCCCCOC(=O)OCOC(=O)C1=NNN=C1C(=O)C2=CC(=C(C=C2[N+](=O)[O-])OC)OC

InChI

InChI=1S/C20H24N4O10/c1-4-5-6-7-8-32-20(27)34-11-33-19(26)17-16(21-23-22-17)18(25)12-9-14(30-2)15(31-3)10-13(12)24(28)29/h9-10H,4-8,11H2,1-3H3,(H,21,22,23)