3-[1-methyl-4-oxidanylidene-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxalin-2-yl]propanoic acid

Systemtic Name: 3-[1-methyl-4-oxidanylidene-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxalin-2-yl]propanoic acid Openeye Name: 3-[1-methyl-4-oxo-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxalin-2-yl]propanoic acid CAS Name: 3-[1-methyl-4-oxo-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxalin-2-yl]propanoic acid IUPAC Name: 3-[1-methyl-4-oxo-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxalin-2-yl]propanoic acid Traditional Name: 3-[4-keto-1-methyl-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxalin-2-yl]propionic acid Formula: C15H12F3N3O3 MolecularWeight: 339.26929

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2N1C3=C(C=C(C=C3)C(F)(F)F)NC2=O)CCC(=O)O

Isomeric SMILES

CC1=C(N=C2N1C3=C(C=C(C=C3)C(F)(F)F)NC2=O)CCC(=O)O

InChI

InChI=1S/C15H12F3N3O3/c1-7-9(3-5-12(22)23)19-13-14(24)20-10-6-8(15(16,17)18)2-4-11(10)21(7)13/h2,4,6H,3,5H2,1H3,(H,20,24)(H,22,23)