6,6-bis(fluoranyl)-6-(1-phenylpyrazol-4-yl)hexanoic acid

Systemtic Name: 6,6-bis(fluoranyl)-6-(1-phenylpyrazol-4-yl)hexanoic acid Openeye Name: 6,6-difluoro-6-(1-phenylpyrazol-4-yl)hexanoic acid CAS Name: 6,6-difluoro-6-(1-phenyl-4-pyrazolyl)hexanoic acid IUPAC Name: 6,6-difluoro-6-(1-phenylpyrazol-4-yl)hexanoic acid Traditional Name: 6,6-difluoro-6-(1-phenylpyrazol-4-yl)hexanoic acid Formula: C15H16F2N2O2 MolecularWeight: 294.296546

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)C(CCCCC(=O)O)(F)F

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)C(CCCCC(=O)O)(F)F

InChI

InChI=1S/C15H16F2N2O2/c16-15(17,9-5-4-8-14(20)21)12-10-18-19(11-12)13-6-2-1-3-7-13/h1-3,6-7,10-11H,4-5,8-9H2,(H,20,21)