2-[2,2,2-tris(fluoranyl)ethanoylamino]quinoline-3-carboxylic acid

Systemtic Name: 2-[2,2,2-tris(fluoranyl)ethanoylamino]quinoline-3-carboxylic acid Openeye Name: 2-[(2,2,2-trifluoroacetyl)amino]quinoline-3-carboxylic acid CAS Name: 2-[(2,2,2-trifluoro-1-oxoethyl)amino]-3-quinolinecarboxylic acid IUPAC Name: 2-[(2,2,2-trifluoroacetyl)amino]quinoline-3-carboxylic acid Traditional Name: 2-[(2,2,2-trifluoroacetyl)amino]quinoline-3-carboxylic acid Formula: C12H7F3N2O3 MolecularWeight: 284.19079

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=N2)NC(=O)C(F)(F)F)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=N2)NC(=O)C(F)(F)F)C(=O)O

InChI

InChI=1S/C12H7F3N2O3/c13-12(14,15)11(20)17-9-7(10(18)19)5-6-3-1-2-4-8(6)16-9/h1-5H,(H,18,19)(H,16,17,20)