3-oxidanylidene-7-[4-(pyridin-4-ylcarbamoyloxymethyl)imidazol-1-yl]-6-(trifluoromethyl)-4H-quinoxaline-2-carboxylic acid

Systemtic Name: 3-oxidanylidene-7-[4-(pyridin-4-ylcarbamoyloxymethyl)imidazol-1-yl]-6-(trifluoromethyl)-4H-quinoxaline-2-carboxylic acid Openeye Name: 3-oxo-7-[4-(4-pyridylcarbamoyloxymethyl)imidazol-1-yl]-6-(trifluoromethyl)-4H-quinoxaline-2-carboxylic acid CAS Name: 3-oxo-7-[4-[[oxo-(pyridin-4-ylamino)methoxy]methyl]-1-imidazolyl]-6-(trifluoromethyl)-4H-quinoxaline-2-carboxylic acid IUPAC Name: 3-oxo-7-[4-(pyridin-4-ylcarbamoyloxymethyl)imidazol-1-yl]-6-(trifluoromethyl)-4H-quinoxaline-2-carboxylic acid Traditional Name: 3-keto-7-[4-(4-pyridylcarbamoyloxymethyl)imidazol-1-yl]-6-(trifluoromethyl)-4H-quinoxaline-2-carboxylic acid Formula: C20H13F3N6O5 MolecularWeight: 474.34963

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1NC(=O)OCC2=CN(C=N2)C3=CC4=C(C=C3C(F)(F)F)NC(=O)C(=N4)C(=O)O

Isomeric SMILES

C1=CN=CC=C1NC(=O)OCC2=CN(C=N2)C3=CC4=C(C=C3C(F)(F)F)NC(=O)C(=N4)C(=O)O

InChI

InChI=1S/C20H13F3N6O5/c21-20(22,23)12-5-13-14(27-16(18(31)32)17(30)28-13)6-15(12)29-7-11(25-9-29)8-34-19(33)26-10-1-3-24-4-2-10/h1-7,9H,8H2,(H,28,30)(H,31,32)(H,24,26,33)