O1-tert-butyl O5-(1-phenylprop-2-enyl) (2S,3S)-3-propyl-2-[2,2,2-tris(fluoranyl)ethanoylamino]pentanedioate

Systemtic Name: O1-tert-butyl O5-(1-phenylprop-2-enyl) (2S,3S)-3-propyl-2-[2,2,2-tris(fluoranyl)ethanoylamino]pentanedioate Openeye Name: O1-tert-butyl O5-(1-phenylallyl) (2S,3S)-3-propyl-2-[(2,2,2-trifluoroacetyl)amino]pentanedioate CAS Name: (2S,3S)-3-propyl-2-[(2,2,2-trifluoro-1-oxoethyl)amino]pentanedioic acid O1-tert-butyl ester O5-(1-phenylprop-2-enyl) ester IUPAC Name: 1-O-tert-butyl 5-O-(1-phenylprop-2-enyl) (2S,3S)-3-propyl-2-[(2,2,2-trifluoroacetyl)amino]pentanedioate Traditional Name: (2S,3S)-3-propyl-2-[(2,2,2-trifluoroacetyl)amino]glutaric acid O1-tert-butyl ester O5-(1-phenylallyl) ester Formula: C23H30F3NO5 MolecularWeight: 457.48321

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC[C@@H](CC(=O)OC(C=C)C1=CC=CC=C1)[C@@H](C(=O)OC(C)(C)C)NC(=O)C(F)(F)F

InChI

InChI=1S/C23H30F3NO5/c1-6-11-16(14-18(28)31-17(7-2)15-12-9-8-10-13-15)19(20(29)32-22(3,4)5)27-21(30)23(24,25)26/h7-10,12-13,16-17,19H,2,6,11,14H2,1,3-5H3,(H,27,30)/t16-,17?,19-/m0/s1