2-[2-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]cyclopenten-1-yl]pyrimidine-4-carboxylic acid

Systemtic Name: 2-[2-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]cyclopenten-1-yl]pyrimidine-4-carboxylic acid Openeye Name: 2-[2-[2-benzyloxy-5-(trifluoromethyl)phenyl]cyclopenten-1-yl]pyrimidine-4-carboxylic acid CAS Name: 2-[2-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]-1-cyclopentenyl]-4-pyrimidinecarboxylic acid IUPAC Name: 2-[2-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]cyclopenten-1-yl]pyrimidine-4-carboxylic acid Traditional Name: 2-[2-[2-benzoxy-5-(trifluoromethyl)phenyl]cyclopenten-1-yl]pyrimidine-4-carboxylic acid Formula: C24H19F3N2O3 MolecularWeight: 440.41447

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(C1)C2=NC=CC(=N2)C(=O)O)C3=C(C=CC(=C3)C(F)(F)F)OCC4=CC=CC=C4

Isomeric SMILES

C1CC(=C(C1)C2=NC=CC(=N2)C(=O)O)C3=C(C=CC(=C3)C(F)(F)F)OCC4=CC=CC=C4

InChI

InChI=1S/C24H19F3N2O3/c25-24(26,27)16-9-10-21(32-14-15-5-2-1-3-6-15)19(13-16)17-7-4-8-18(17)22-28-12-11-20(29-22)23(30)31/h1-3,5-6,9-13H,4,7-8,14H2,(H,30,31)