2-[4-butyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-5-yl]ethanoic acid

Systemtic Name: 2-[4-butyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-5-yl]ethanoic acid Openeye Name: 2-[4-butyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-5-yl]acetic acid CAS Name: 2-[4-butyl-2-[4-(trifluoromethyl)phenyl]-5-pyrimidinyl]acetic acid IUPAC Name: 2-[4-butyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-5-yl]acetic acid Traditional Name: 2-[4-butyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-5-yl]acetic acid Formula: C17H17F3N2O2 MolecularWeight: 338.32429

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=NC=C1CC(=O)O)C2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CCCCC1=NC(=NC=C1CC(=O)O)C2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C17H17F3N2O2/c1-2-3-4-14-12(9-15(23)24)10-21-16(22-14)11-5-7-13(8-6-11)17(18,19)20/h5-8,10H,2-4,9H2,1H3,(H,23,24)