(2S)-1-[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[6-methyl-2-(trifluoromethyl)-4-quinazolinyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]proline Formula: C15H14F3N3O2 MolecularWeight: 325.28577

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N=C2N3CCCC3C(=O)O)C(F)(F)F

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N=C2N3CCC[C@H]3C(=O)O)C(F)(F)F

InChI

InChI=1S/C15H14F3N3O2/c1-8-4-5-10-9(7-8)12(20-14(19-10)15(16,17)18)21-6-2-3-11(21)13(22)23/h4-5,7,11H,2-3,6H2,1H3,(H,22,23)/t11-/m0/s1