methyl (2S)-3,3,3-tris(fluoranyl)-2-(2-methyl-4-oxidanyl-5-propan-2-yl-phenyl)-2-oxidanyl-propanoate

Systemtic Name: methyl (2S)-3,3,3-tris(fluoranyl)-2-(2-methyl-4-oxidanyl-5-propan-2-yl-phenyl)-2-oxidanyl-propanoate Openeye Name: methyl (2S)-3,3,3-trifluoro-2-hydroxy-2-(4-hydroxy-5-isopropyl-2-methyl-phenyl)propanoate CAS Name: (2S)-3,3,3-trifluoro-2-hydroxy-2-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)propanoic acid methyl ester IUPAC Name: methyl (2S)-3,3,3-trifluoro-2-hydroxy-2-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)propanoate Traditional Name: (2S)-3,3,3-trifluoro-2-hydroxy-2-(4-hydroxy-5-isopropyl-2-methyl-phenyl)propionic acid methyl ester Formula: C14H17F3O4 MolecularWeight: 306.27759

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(C(=O)OC)(C(F)(F)F)O)C(C)C)O

Isomeric SMILES

CC1=CC(=C(C=C1[C@](C(=O)OC)(C(F)(F)F)O)C(C)C)O

InChI

InChI=1S/C14H17F3O4/c1-7(2)9-6-10(8(3)5-11(9)18)13(20,12(19)21-4)14(15,16)17/h5-7,18,20H,1-4H3/t13-/m0/s1