4-dec-1-ynyl-3-fluoranyl-benzoic acid

Systemtic Name: 4-dec-1-ynyl-3-fluoranyl-benzoic acid Openeye Name: 4-dec-1-ynyl-3-fluoro-benzoic acid CAS Name: 4-dec-1-ynyl-3-fluorobenzoic acid IUPAC Name: 4-dec-1-ynyl-3-fluorobenzoic acid Traditional Name: 4-dec-1-ynyl-3-fluoro-benzoic acid Formula: C17H21FO2 MolecularWeight: 276.345843

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21FO2/c1-2-3-4-5-6-7-8-9-10-14-11-12-15(17(19)20)13-16(14)18/h11-13H,2-8H2,1H3,(H,19,20)