(2S)-2-[[2-(trifluoromethyl)quinazolin-4-yl]amino]propanoate

Systemtic Name: (2S)-2-[[2-(trifluoromethyl)quinazolin-4-yl]amino]propanoate Openeye Name: (2S)-2-[[2-(trifluoromethyl)quinazolin-4-yl]amino]propanoate CAS Name: (2S)-2-[[2-(trifluoromethyl)-4-quinazolinyl]amino]propanoate IUPAC Name: (2S)-2-[[2-(trifluoromethyl)quinazolin-4-yl]amino]propanoate Traditional Name: (2S)-2-[[2-(trifluoromethyl)quinazolin-4-yl]amino]propionate Formula: C12H9F3N3O2- MolecularWeight: 284.21397

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])NC1=NC(=NC2=CC=CC=C21)C(F)(F)F

Isomeric SMILES

C[C@@H](C(=O)[O-])NC1=NC(=NC2=CC=CC=C21)C(F)(F)F

InChI

InChI=1S/C12H10F3N3O2/c1-6(10(19)20)16-9-7-4-2-3-5-8(7)17-11(18-9)12(13,14)15/h2-6H,1H3,(H,19,20)(H,16,17,18)/p-1/t6-/m0/s1