1-(imidazol-1-ylmethyl)-4-oxidanylidene-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxaline-2-carboxylic acid

Systemtic Name: 1-(imidazol-1-ylmethyl)-4-oxidanylidene-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxaline-2-carboxylic acid Openeye Name: 1-(imidazol-1-ylmethyl)-4-oxo-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxaline-2-carboxylic acid CAS Name: 1-(1-imidazolylmethyl)-4-oxo-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxaline-2-carboxylic acid IUPAC Name: 1-(imidazol-1-ylmethyl)-4-oxo-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxaline-2-carboxylic acid Traditional Name: 1-(imidazol-1-ylmethyl)-4-keto-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxaline-2-carboxylic acid Formula: C16H10F3N5O3 MolecularWeight: 377.27751

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(F)(F)F)NC(=O)C3=NC(=C(N23)CN4C=CN=C4)C(=O)O

Isomeric SMILES

C1=CC2=C(C=C1C(F)(F)F)NC(=O)C3=NC(=C(N23)CN4C=CN=C4)C(=O)O

InChI

InChI=1S/C16H10F3N5O3/c17-16(18,19)8-1-2-10-9(5-8)21-14(25)13-22-12(15(26)27)11(24(10)13)6-23-4-3-20-7-23/h1-5,7H,6H2,(H,21,25)(H,26,27)