[(3R,5S)-1-(2-ethoxy-2-oxidanylidene-ethyl)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanylidene-piperidin-3-yl] (2S)-3,3,3-tris(fluoranyl)-2-methoxy-2-phenyl-propanoate

Systemtic Name: [(3R,5S)-1-(2-ethoxy-2-oxidanylidene-ethyl)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanylidene-piperidin-3-yl] (2S)-3,3,3-tris(fluoranyl)-2-methoxy-2-phenyl-propanoate Openeye Name: [(3R,5S)-5-(tert-butoxycarbonylamino)-1-(2-ethoxy-2-oxo-ethyl)-2-oxo-3-piperidyl] (2S)-3,3,3-trifluoro-2-methoxy-2-phenyl-propanoate CAS Name: (2S)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoic acid [(3R,5S)-1-(2-ethoxy-2-oxoethyl)-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-oxo-3-piperidinyl] ester IUPAC Name: [(3R,5S)-1-(2-ethoxy-2-oxoethyl)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxopiperidin-3-yl] (2S)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoate Traditional Name: (2S)-3,3,3-trifluoro-2-methoxy-2-phenyl-propionic acid [(3R,5S)-5-(tert-butoxycarbonylamino)-1-(2-ethoxy-2-keto-ethyl)-2-keto-3-piperidyl] ester Formula: C24H31F3N2O8 MolecularWeight: 532.50675

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1CC(CC(C1=O)OC(=O)C(C2=CC=CC=C2)(C(F)(F)F)OC)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)CN1C[C@H](C[C@H](C1=O)OC(=O)[C@@](C2=CC=CC=C2)(C(F)(F)F)OC)NC(=O)OC(C)(C)C

InChI

InChI=1S/C24H31F3N2O8/c1-6-35-18(30)14-29-13-16(28-21(33)37-22(2,3)4)12-17(19(29)31)36-20(32)23(34-5,24(25,26)27)15-10-8-7-9-11-15/h7-11,16-17H,6,12-14H2,1-5H3,(H,28,33)/t16-,17+,23-/m0/s1