ethyl (2R,3S)-4-oxidanyl-3-phenylmethoxy-2-(phenylmethoxycarbonylamino)-2-(trifluoromethyl)butanoate

Systemtic Name: ethyl (2R,3S)-4-oxidanyl-3-phenylmethoxy-2-(phenylmethoxycarbonylamino)-2-(trifluoromethyl)butanoate Openeye Name: ethyl (2R,3S)-3-benzyloxy-2-(benzyloxycarbonylamino)-4-hydroxy-2-(trifluoromethyl)butanoate CAS Name: (2R,3S)-4-hydroxy-3-phenylmethoxy-2-(phenylmethoxycarbonylamino)-2-(trifluoromethyl)butanoic acid ethyl ester IUPAC Name: ethyl (2R,3S)-4-hydroxy-3-phenylmethoxy-2-(phenylmethoxycarbonylamino)-2-(trifluoromethyl)butanoate Traditional Name: (2R,3S)-3-benzoxy-2-(benzyloxycarbonylamino)-4-hydroxy-2-(trifluoromethyl)butyric acid ethyl ester Formula: C22H24F3NO6 MolecularWeight: 455.42427

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(CO)OCC1=CC=CC=C1)(C(F)(F)F)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)[C@]([C@@H](CO)OCC1=CC=CC=C1)(C(F)(F)F)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H24F3NO6/c1-2-30-19(28)21(22(23,24)25,18(13-27)31-14-16-9-5-3-6-10-16)26-20(29)32-15-17-11-7-4-8-12-17/h3-12,18,27H,2,13-15H2,1H3,(H,26,29)/t18-,21-/m1/s1