5-(3-fluoranyl-4-iodanyl-2-prop-2-enyl-phenyl)-3-methyl-3-(phenylmethyl)pentanoic acid

Systemtic Name: 5-(3-fluoranyl-4-iodanyl-2-prop-2-enyl-phenyl)-3-methyl-3-(phenylmethyl)pentanoic acid Openeye Name: 5-(2-allyl-3-fluoro-4-iodo-phenyl)-3-benzyl-3-methyl-pentanoic acid CAS Name: 5-(3-fluoro-4-iodo-2-prop-2-enylphenyl)-3-methyl-3-(phenylmethyl)pentanoic acid IUPAC Name: 3-benzyl-5-(3-fluoro-4-iodo-2-prop-2-enylphenyl)-3-methylpentanoic acid Traditional Name: 5-(2-allyl-3-fluoro-4-iodo-phenyl)-3-benzyl-3-methyl-valeric acid Formula: C22H24FIO2 MolecularWeight: 466.327633

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=C(C(=C(C=C1)I)F)CC=C)(CC2=CC=CC=C2)CC(=O)O

Isomeric SMILES

CC(CCC1=C(C(=C(C=C1)I)F)CC=C)(CC2=CC=CC=C2)CC(=O)O

InChI

InChI=1S/C22H24FIO2/c1-3-7-18-17(10-11-19(24)21(18)23)12-13-22(2,15-20(25)26)14-16-8-5-4-6-9-16/h3-6,8-11H,1,7,12-15H2,2H3,(H,25,26)