7-nitro-2-oxidanylidene-6-[4-[[2-(trifluoromethyl)phenyl]carbamoyloxymethyl]imidazol-1-yl]-1H-quinoline-3-carboxylic acid

Systemtic Name: 7-nitro-2-oxidanylidene-6-[4-[[2-(trifluoromethyl)phenyl]carbamoyloxymethyl]imidazol-1-yl]-1H-quinoline-3-carboxylic acid Openeye Name: 7-nitro-2-oxo-6-[4-[[2-(trifluoromethyl)phenyl]carbamoyloxymethyl]imidazol-1-yl]-1H-quinoline-3-carboxylic acid CAS Name: 7-nitro-2-oxo-6-[4-[[oxo-[2-(trifluoromethyl)anilino]methoxy]methyl]-1-imidazolyl]-1H-quinoline-3-carboxylic acid IUPAC Name: 7-nitro-2-oxo-6-[4-[[2-(trifluoromethyl)phenyl]carbamoyloxymethyl]imidazol-1-yl]-1H-quinoline-3-carboxylic acid Traditional Name: 2-keto-7-nitro-6-[4-[[2-(trifluoromethyl)phenyl]carbamoyloxymethyl]imidazol-1-yl]-1H-quinoline-3-carboxylic acid Formula: C22H14F3N5O7 MolecularWeight: 517.37107

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(F)(F)F)NC(=O)OCC2=CN(C=N2)C3=C(C=C4C(=C3)C=C(C(=O)N4)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(F)(F)F)NC(=O)OCC2=CN(C=N2)C3=C(C=C4C(=C3)C=C(C(=O)N4)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C22H14F3N5O7/c23-22(24,25)14-3-1-2-4-15(14)28-21(34)37-9-12-8-29(10-26-12)17-6-11-5-13(20(32)33)19(31)27-16(11)7-18(17)30(35)36/h1-8,10H,9H2,(H,27,31)(H,28,34)(H,32,33)