methyl 2-(3-tert-butyl-4-oxidanyl-phenyl)-3,3,3-tris(fluoranyl)-2-oxidanyl-propanoate

Systemtic Name: methyl 2-(3-tert-butyl-4-oxidanyl-phenyl)-3,3,3-tris(fluoranyl)-2-oxidanyl-propanoate Openeye Name: methyl 2-(3-tert-butyl-4-hydroxy-phenyl)-3,3,3-trifluoro-2-hydroxy-propanoate CAS Name: 2-(3-tert-butyl-4-hydroxyphenyl)-3,3,3-trifluoro-2-hydroxypropanoic acid methyl ester IUPAC Name: methyl 2-(3-tert-butyl-4-hydroxyphenyl)-3,3,3-trifluoro-2-hydroxypropanoate Traditional Name: 2-(3-tert-butyl-4-hydroxy-phenyl)-3,3,3-trifluoro-2-hydroxy-propionic acid methyl ester Formula: C14H17F3O4 MolecularWeight: 306.27759

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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