(3-methyl-3-oxidanyl-heptyl) 3,3,3-tris(fluoranyl)-2-methoxy-2-phenyl-propanoate

Systemtic Name: (3-methyl-3-oxidanyl-heptyl) 3,3,3-tris(fluoranyl)-2-methoxy-2-phenyl-propanoate Openeye Name: (3-hydroxy-3-methyl-heptyl) 3,3,3-trifluoro-2-methoxy-2-phenyl-propanoate CAS Name: 3,3,3-trifluoro-2-methoxy-2-phenylpropanoic acid (3-hydroxy-3-methylheptyl) ester IUPAC Name: (3-hydroxy-3-methylheptyl) 3,3,3-trifluoro-2-methoxy-2-phenylpropanoate Traditional Name: 3,3,3-trifluoro-2-methoxy-2-phenyl-propionic acid (3-hydroxy-3-methyl-heptyl) ester Formula: C18H25F3O4 MolecularWeight: 362.38391

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25F3O4/c1-4-5-11-16(2,23)12-13-25-15(22)17(24-3,18(19,20)21)14-9-7-6-8-10-14/h6-10,23H,4-5,11-13H2,1-3H3