methyl 2-(3,5-dimethyl-4-oxidanyl-phenyl)-3,3,3-tris(fluoranyl)-2-phenoxy-propanoate

Systemtic Name: methyl 2-(3,5-dimethyl-4-oxidanyl-phenyl)-3,3,3-tris(fluoranyl)-2-phenoxy-propanoate Openeye Name: methyl 3,3,3-trifluoro-2-(4-hydroxy-3,5-dimethyl-phenyl)-2-phenoxy-propanoate CAS Name: 3,3,3-trifluoro-2-(4-hydroxy-3,5-dimethylphenyl)-2-phenoxypropanoic acid methyl ester IUPAC Name: methyl 3,3,3-trifluoro-2-(4-hydroxy-3,5-dimethylphenyl)-2-phenoxypropanoate Traditional Name: 3,3,3-trifluoro-2-(4-hydroxy-3,5-dimethyl-phenyl)-2-phenoxy-propionic acid methyl ester Formula: C18H17F3O4 MolecularWeight: 354.32039

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)C(C(=O)OC)(C(F)(F)F)OC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=CC(=C1O)C)C(C(=O)OC)(C(F)(F)F)OC2=CC=CC=C2

InChI

InChI=1S/C18H17F3O4/c1-11-9-13(10-12(2)15(11)22)17(16(23)24-3,18(19,20)21)25-14-7-5-4-6-8-14/h4-10,22H,1-3H3