2-[2-(2-azanyl-4-methyl-pyrimidin-5-yl)-4-(trifluoromethyl)phenoxy]ethanoic acid

Systemtic Name: 2-[2-(2-azanyl-4-methyl-pyrimidin-5-yl)-4-(trifluoromethyl)phenoxy]ethanoic acid Openeye Name: 2-[2-(2-amino-4-methyl-pyrimidin-5-yl)-4-(trifluoromethyl)phenoxy]acetic acid CAS Name: 2-[2-(2-amino-4-methyl-5-pyrimidinyl)-4-(trifluoromethyl)phenoxy]acetic acid IUPAC Name: 2-[2-(2-amino-4-methylpyrimidin-5-yl)-4-(trifluoromethyl)phenoxy]acetic acid Traditional Name: 2-[2-(2-amino-4-methyl-pyrimidin-5-yl)-4-(trifluoromethyl)phenoxy]acetic acid Formula: C14H12F3N3O3 MolecularWeight: 327.25859

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C2=C(C=CC(=C2)C(F)(F)F)OCC(=O)O)N

Isomeric SMILES

CC1=NC(=NC=C1C2=C(C=CC(=C2)C(F)(F)F)OCC(=O)O)N

InChI

InChI=1S/C14H12F3N3O3/c1-7-10(5-19-13(18)20-7)9-4-8(14(15,16)17)2-3-11(9)23-6-12(21)22/h2-5H,6H2,1H3,(H,21,22)(H2,18,19,20)