2-fluoranyl-2-(phenylmethyl)octadecanoic acid

Systemtic Name: 2-fluoranyl-2-(phenylmethyl)octadecanoic acid Openeye Name: 2-benzyl-2-fluoro-octadecanoic acid CAS Name: 2-fluoro-2-(phenylmethyl)octadecanoic acid IUPAC Name: 2-benzyl-2-fluorooctadecanoic acid Traditional Name: 2-benzyl-2-fluoro-stearic acid Formula: C25H41FO2 MolecularWeight: 392.590243

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(CC1=CC=CC=C1)(C(=O)O)F

Isomeric SMILES

CCCCCCCCCCCCCCCCC(CC1=CC=CC=C1)(C(=O)O)F

InChI

InChI=1S/C25H41FO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-21-25(26,24(27)28)22-23-19-16-15-17-20-23/h15-17,19-20H,2-14,18,21-22H2,1H3,(H,27,28)