4-oxidanidyl-3-(trifluoromethyl)-1,2-dihydroquinoxalin-4-ium-6-carboxylic acid

Systemtic Name: 4-oxidanidyl-3-(trifluoromethyl)-1,2-dihydroquinoxalin-4-ium-6-carboxylic acid Openeye Name: 4-oxido-3-(trifluoromethyl)-1,2-dihydroquinoxalin-4-ium-6-carboxylic acid CAS Name: 4-oxido-3-(trifluoromethyl)-1,2-dihydroquinoxalin-4-ium-6-carboxylic acid IUPAC Name: 4-oxido-3-(trifluoromethyl)-1,2-dihydroquinoxalin-4-ium-6-carboxylic acid Traditional Name: 4-oxido-3-(trifluoromethyl)-1,2-dihydroquinoxalin-4-ium-6-carboxylic acid Formula: C10H7F3N2O3 MolecularWeight: 260.16939

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=[N+](C2=C(N1)C=CC(=C2)C(=O)O)[O-])C(F)(F)F

Isomeric SMILES

C1C(=[N+](C2=C(N1)C=CC(=C2)C(=O)O)[O-])C(F)(F)F

InChI

InChI=1S/C10H7F3N2O3/c11-10(12,13)8-4-14-6-2-1-5(9(16)17)3-7(6)15(8)18/h1-3,14H,4H2,(H,16,17)