ethyl 3-(2,4-dinitrophenyl)-2-[1-(2,4-dinitrophenyl)imidazol-2-yl]-2H-imidazole-1-carboxylate

Systemtic Name: ethyl 3-(2,4-dinitrophenyl)-2-[1-(2,4-dinitrophenyl)imidazol-2-yl]-2H-imidazole-1-carboxylate Openeye Name: ethyl 3-(2,4-dinitrophenyl)-2-[1-(2,4-dinitrophenyl)imidazol-2-yl]-2H-imidazole-1-carboxylate CAS Name: 3-(2,4-dinitrophenyl)-2-[1-(2,4-dinitrophenyl)-2-imidazolyl]-2H-imidazole-1-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(2,4-dinitrophenyl)-2-[1-(2,4-dinitrophenyl)imidazol-2-yl]-2H-imidazole-1-carboxylate Traditional Name: 3-(2,4-dinitrophenyl)-2-[1-(2,4-dinitrophenyl)imidazol-2-yl]-4-imidazoline-1-carboxylic acid ethyl ester Formula: C21H16N8O10 MolecularWeight: 540.39934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C=CN(C1C2=NC=CN2C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)N1C=CN(C1C2=NC=CN2C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H16N8O10/c1-2-39-21(30)25-10-9-24(16-6-4-14(27(33)34)12-18(16)29(37)38)20(25)19-22-7-8-23(19)15-5-3-13(26(31)32)11-17(15)28(35)36/h3-12,20H,2H2,1H3