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

Systemtic Name: 4-[2-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]cyclopenten-1-yl]pyridine-2-carboxylic acid Openeye Name: 4-[2-[2-benzyloxy-5-(trifluoromethyl)phenyl]cyclopenten-1-yl]pyridine-2-carboxylic acid CAS Name: 4-[2-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]-1-cyclopentenyl]-2-pyridinecarboxylic acid IUPAC Name: 4-[2-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]cyclopenten-1-yl]pyridine-2-carboxylic acid Traditional Name: 4-[2-[2-benzoxy-5-(trifluoromethyl)phenyl]cyclopenten-1-yl]picolinic acid Formula: C25H20F3NO3 MolecularWeight: 439.42641

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(C1)C2=C(C=CC(=C2)C(F)(F)F)OCC3=CC=CC=C3)C4=CC(=NC=C4)C(=O)O

Isomeric SMILES

C1CC(=C(C1)C2=C(C=CC(=C2)C(F)(F)F)OCC3=CC=CC=C3)C4=CC(=NC=C4)C(=O)O

InChI

InChI=1S/C25H20F3NO3/c26-25(27,28)18-9-10-23(32-15-16-5-2-1-3-6-16)21(14-18)20-8-4-7-19(20)17-11-12-29-22(13-17)24(30)31/h1-3,5-6,9-14H,4,7-8,15H2,(H,30,31)