methyl (1R,5S)-5-phenyl-8-[(2R)-3,3,3-tris(fluoranyl)-2-methoxy-2-phenyl-propanoyl]-8-azabicyclo[3.2.1]oct-2-ene-2-carboxylate

Systemtic Name: methyl (1R,5S)-5-phenyl-8-[(2R)-3,3,3-tris(fluoranyl)-2-methoxy-2-phenyl-propanoyl]-8-azabicyclo[3.2.1]oct-2-ene-2-carboxylate Openeye Name: methyl (1R,5S)-5-phenyl-8-[(2R)-3,3,3-trifluoro-2-methoxy-2-phenyl-propanoyl]-8-azabicyclo[3.2.1]oct-2-ene-2-carboxylate CAS Name: (1R,5S)-5-phenyl-8-[(2R)-3,3,3-trifluoro-2-methoxy-1-oxo-2-phenylpropyl]-8-azabicyclo[3.2.1]oct-2-ene-2-carboxylic acid methyl ester IUPAC Name: methyl (1R,5S)-5-phenyl-8-[(2R)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl]-8-azabicyclo[3.2.1]oct-2-ene-2-carboxylate Traditional Name: (1R,5S)-5-phenyl-8-[(2R)-3,3,3-trifluoro-2-methoxy-2-phenyl-propanoyl]-8-azabicyclo[3.2.1]oct-2-ene-2-carboxylic acid methyl ester Formula: C25H24F3NO4 MolecularWeight: 459.45757

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CCC2(CCC1N2C(=O)C(C3=CC=CC=C3)(C(F)(F)F)OC)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC[C@@]2(CC[C@H]1N2C(=O)[C@](C3=CC=CC=C3)(C(F)(F)F)OC)C4=CC=CC=C4

InChI

InChI=1S/C25H24F3NO4/c1-32-21(30)19-13-15-23(17-9-5-3-6-10-17)16-14-20(19)29(23)22(31)24(33-2,25(26,27)28)18-11-7-4-8-12-18/h3-13,20H,14-16H2,1-2H3/t20-,23-,24-/m1/s1