4-[5-methyl-6-[[4-(trifluoromethyloxy)phenyl]amino]pyrimidin-4-yl]benzoic acid

Systemtic Name: 4-[5-methyl-6-[[4-(trifluoromethyloxy)phenyl]amino]pyrimidin-4-yl]benzoic acid Openeye Name: 4-[5-methyl-6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]benzoic acid CAS Name: 4-[5-methyl-6-[4-(trifluoromethoxy)anilino]-4-pyrimidinyl]benzoic acid IUPAC Name: 4-[5-methyl-6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]benzoic acid Traditional Name: 4-[5-methyl-6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]benzoic acid Formula: C19H14F3N3O3 MolecularWeight: 389.32797

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN=C1NC2=CC=C(C=C2)OC(F)(F)F)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=C(N=CN=C1NC2=CC=C(C=C2)OC(F)(F)F)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C19H14F3N3O3/c1-11-16(12-2-4-13(5-3-12)18(26)27)23-10-24-17(11)25-14-6-8-15(9-7-14)28-19(20,21)22/h2-10H,1H3,(H,26,27)(H,23,24,25)