2-(5-methyl-2-nitro-imidazol-1-yl)ethyl N-[4-(trifluoromethyl)phenyl]carbonylcarbamate

Systemtic Name: 2-(5-methyl-2-nitro-imidazol-1-yl)ethyl N-[4-(trifluoromethyl)phenyl]carbonylcarbamate Openeye Name: 2-(5-methyl-2-nitro-imidazol-1-yl)ethyl N-[4-(trifluoromethyl)benzoyl]carbamate CAS Name: N-[oxo-[4-(trifluoromethyl)phenyl]methyl]carbamic acid 2-(5-methyl-2-nitro-1-imidazolyl)ethyl ester IUPAC Name: 2-(5-methyl-2-nitroimidazol-1-yl)ethyl N-[4-(trifluoromethyl)benzoyl]carbamate Traditional Name: N-[4-(trifluoromethyl)benzoyl]carbamic acid 2-(5-methyl-2-nitro-imidazol-1-yl)ethyl ester Formula: C15H13F3N4O5 MolecularWeight: 386.28273

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N1CCOC(=O)NC(=O)C2=CC=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CN=C(N1CCOC(=O)NC(=O)C2=CC=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C15H13F3N4O5/c1-9-8-19-13(22(25)26)21(9)6-7-27-14(24)20-12(23)10-2-4-11(5-3-10)15(16,17)18/h2-5,8H,6-7H2,1H3,(H,20,23,24)