ethyl 4-[[4-nitro-2-(phenylcarbonyl)phenyl]carbamoyl]-1H-imidazole-5-carboxylate

Systemtic Name: ethyl 4-[[4-nitro-2-(phenylcarbonyl)phenyl]carbamoyl]-1H-imidazole-5-carboxylate Openeye Name: ethyl 4-[(2-benzoyl-4-nitro-phenyl)carbamoyl]-1H-imidazole-5-carboxylate CAS Name: 4-[(2-benzoyl-4-nitroanilino)-oxomethyl]-1H-imidazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2-benzoyl-4-nitrophenyl)carbamoyl]-1H-imidazole-5-carboxylate Traditional Name: 4-[(2-benzoyl-4-nitro-phenyl)carbamoyl]-1H-imidazole-5-carboxylic acid ethyl ester Formula: C20H16N4O6 MolecularWeight: 408.36424

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=CN1)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(N=CN1)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H16N4O6/c1-2-30-20(27)17-16(21-11-22-17)19(26)23-15-9-8-13(24(28)29)10-14(15)18(25)12-6-4-3-5-7-12/h3-11H,2H2,1H3,(H,21,22)(H,23,26)