3-[[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]amino]propanoic acid

Systemtic Name: 3-[[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]amino]propanoic acid Openeye Name: 3-[[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]amino]propanoic acid CAS Name: 3-[[6-methyl-2-(trifluoromethyl)-4-quinazolinyl]amino]propanoic acid IUPAC Name: 3-[[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]amino]propanoic acid Traditional Name: 3-[[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]amino]propionic acid Formula: C13H12F3N3O2 MolecularWeight: 299.24849

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N=C2NCCC(=O)O)C(F)(F)F

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N=C2NCCC(=O)O)C(F)(F)F

InChI

InChI=1S/C13H12F3N3O2/c1-7-2-3-9-8(6-7)11(17-5-4-10(20)21)19-12(18-9)13(14,15)16/h2-3,6H,4-5H2,1H3,(H,20,21)(H,17,18,19)