O1-ethyl O4-(phenylmethyl) (2R)-2-oxidanyl-2-[4-(trifluoromethyl)phenyl]butanedioate

Systemtic Name: O1-ethyl O4-(phenylmethyl) (2R)-2-oxidanyl-2-[4-(trifluoromethyl)phenyl]butanedioate Openeye Name: O4-benzyl O1-ethyl (2R)-2-hydroxy-2-[4-(trifluoromethyl)phenyl]butanedioate CAS Name: (2R)-2-hydroxy-2-[4-(trifluoromethyl)phenyl]butanedioic acid O1-ethyl ester O4-(phenylmethyl) ester IUPAC Name: 4-O-benzyl 1-O-ethyl (2R)-2-hydroxy-2-[4-(trifluoromethyl)phenyl]butanedioate Traditional Name: (2R)-2-hydroxy-2-[4-(trifluoromethyl)phenyl]succinic acid O4-benzyl ester O1-ethyl ester Formula: C20H19F3O5 MolecularWeight: 396.35707

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(=O)OCC1=CC=CC=C1)(C2=CC=C(C=C2)C(F)(F)F)O

Isomeric SMILES

CCOC(=O)[C@@](CC(=O)OCC1=CC=CC=C1)(C2=CC=C(C=C2)C(F)(F)F)O

InChI

InChI=1S/C20H19F3O5/c1-2-27-18(25)19(26,15-8-10-16(11-9-15)20(21,22)23)12-17(24)28-13-14-6-4-3-5-7-14/h3-11,26H,2,12-13H2,1H3/t19-/m1/s1