2,5-bis(fluoranyl)-4-(4-pentylphenyl)benzoic acid

Systemtic Name: 2,5-bis(fluoranyl)-4-(4-pentylphenyl)benzoic acid Openeye Name: 2,5-difluoro-4-(4-pentylphenyl)benzoic acid CAS Name: 2,5-difluoro-4-(4-pentylphenyl)benzoic acid IUPAC Name: 2,5-difluoro-4-(4-pentylphenyl)benzoic acid Traditional Name: 4-(4-amylphenyl)-2,5-difluoro-benzoic acid Formula: C18H18F2O2 MolecularWeight: 304.331126

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2=CC(=C(C=C2F)C(=O)O)F

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2=CC(=C(C=C2F)C(=O)O)F

InChI

InChI=1S/C18H18F2O2/c1-2-3-4-5-12-6-8-13(9-7-12)14-10-17(20)15(18(21)22)11-16(14)19/h6-11H,2-5H2,1H3,(H,21,22)