4-(4-dec-1-ynyl-3-fluoranyl-phenyl)benzoic acid

Systemtic Name: 4-(4-dec-1-ynyl-3-fluoranyl-phenyl)benzoic acid Openeye Name: 4-(4-dec-1-ynyl-3-fluoro-phenyl)benzoic acid CAS Name: 4-(4-dec-1-ynyl-3-fluorophenyl)benzoic acid IUPAC Name: 4-(4-dec-1-ynyl-3-fluorophenyl)benzoic acid Traditional Name: 4-(4-dec-1-ynyl-3-fluoro-phenyl)benzoic acid Formula: C23H25FO2 MolecularWeight: 352.441803

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC#CC1=C(C=C(C=C1)C2=CC=C(C=C2)C(=O)O)F

Isomeric SMILES

CCCCCCCCC#CC1=C(C=C(C=C1)C2=CC=C(C=C2)C(=O)O)F

InChI

InChI=1S/C23H25FO2/c1-2-3-4-5-6-7-8-9-10-19-13-16-21(17-22(19)24)18-11-14-20(15-12-18)23(25)26/h11-17H,2-8H2,1H3,(H,25,26)