7-fluoranyl-7-tetradecyl-tridecanedioic acid

Systemtic Name: 7-fluoranyl-7-tetradecyl-tridecanedioic acid Openeye Name: 7-fluoro-7-tetradecyl-tridecanedioic acid CAS Name: 7-fluoro-7-tetradecyltridecanedioic acid IUPAC Name: 7-fluoro-7-tetradecyltridecanedioic acid Traditional Name: 7-fluoro-7-myristyl-brassylic acid Formula: C27H51FO4 MolecularWeight: 458.689843

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(CCCCCC(=O)O)(CCCCCC(=O)O)F

Isomeric SMILES

CCCCCCCCCCCCCCC(CCCCCC(=O)O)(CCCCCC(=O)O)F

InChI

InChI=1S/C27H51FO4/c1-2-3-4-5-6-7-8-9-10-11-12-17-22-27(28,23-18-13-15-20-25(29)30)24-19-14-16-21-26(31)32/h2-24H2,1H3,(H,29,30)(H,31,32)