diethyl (3aR,6S)-6-[4-(trifluoromethyloxy)phenyl]-3,3a,4,6-tetrahydrocyclopenta[c][1,2]oxazole-5,5-dicarboxylate

Systemtic Name: diethyl (3aR,6S)-6-[4-(trifluoromethyloxy)phenyl]-3,3a,4,6-tetrahydrocyclopenta[c][1,2]oxazole-5,5-dicarboxylate Openeye Name: diethyl (3aR,6S)-6-[4-(trifluoromethoxy)phenyl]-3,3a,4,6-tetrahydrocyclopenta[c]isoxazole-5,5-dicarboxylate CAS Name: (3aR,6S)-6-[4-(trifluoromethoxy)phenyl]-3,3a,4,6-tetrahydrocyclopenta[c]isoxazole-5,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl (3aR,6S)-6-[4-(trifluoromethoxy)phenyl]-3,3a,4,6-tetrahydrocyclopenta[c][1,2]oxazole-5,5-dicarboxylate Traditional Name: (3aR,6S)-6-[4-(trifluoromethoxy)phenyl]-3,3a,4,6-tetrahydrocyclopent[c]isoxazole-5,5-dicarboxylic acid diethyl ester Formula: C19H20F3NO6 MolecularWeight: 415.36041

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC2CON=C2C1C3=CC=C(C=C3)OC(F)(F)F)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1(C[C@H]2CON=C2[C@H]1C3=CC=C(C=C3)OC(F)(F)F)C(=O)OCC

InChI

InChI=1S/C19H20F3NO6/c1-3-26-16(24)18(17(25)27-4-2)9-12-10-28-23-15(12)14(18)11-5-7-13(8-6-11)29-19(20,21)22/h5-8,12,14H,3-4,9-10H2,1-2H3/t12-,14+/m0/s1