ethyl 5-chloranyl-1-(2,4-dinitrophenyl)-2-methyl-imidazole-4-carboxylate

Systemtic Name: ethyl 5-chloranyl-1-(2,4-dinitrophenyl)-2-methyl-imidazole-4-carboxylate Openeye Name: ethyl 5-chloro-1-(2,4-dinitrophenyl)-2-methyl-imidazole-4-carboxylate CAS Name: 5-chloro-1-(2,4-dinitrophenyl)-2-methyl-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-chloro-1-(2,4-dinitrophenyl)-2-methylimidazole-4-carboxylate Traditional Name: 5-chloro-1-(2,4-dinitrophenyl)-2-methyl-imidazole-4-carboxylic acid ethyl ester Formula: C13H11ClN4O6 MolecularWeight: 354.70264

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=N1)C)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])Cl

Isomeric SMILES

CCOC(=O)C1=C(N(C(=N1)C)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])Cl

InChI

InChI=1S/C13H11ClN4O6/c1-3-24-13(19)11-12(14)16(7(2)15-11)9-5-4-8(17(20)21)6-10(9)18(22)23/h4-6H,3H2,1-2H3