2-[(2,4-dimethylphenyl)methyl]-3,3,3-tris(fluoranyl)propanoic acid

Systemtic Name: 2-[(2,4-dimethylphenyl)methyl]-3,3,3-tris(fluoranyl)propanoic acid Openeye Name: 2-[(2,4-dimethylphenyl)methyl]-3,3,3-trifluoro-propanoic acid CAS Name: 2-[(2,4-dimethylphenyl)methyl]-3,3,3-trifluoropropanoic acid IUPAC Name: 2-[(2,4-dimethylphenyl)methyl]-3,3,3-trifluoropropanoic acid Traditional Name: 2-(2,4-dimethylbenzyl)-3,3,3-trifluoro-propionic acid Formula: C12H13F3O2 MolecularWeight: 246.22563

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13F3O2/c1-7-3-4-9(8(2)5-7)6-10(11(16)17)12(13,14)15/h3-5,10H,6H2,1-2H3,(H,16,17)