[3-(4-fluorophenyl)-4-(phenylmethyl)morpholin-2-yl] 3,5-bis(trifluoromethyl)benzoate

Systemtic Name: [3-(4-fluorophenyl)-4-(phenylmethyl)morpholin-2-yl] 3,5-bis(trifluoromethyl)benzoate Openeye Name: [4-benzyl-3-(4-fluorophenyl)morpholin-2-yl] 3,5-bis(trifluoromethyl)benzoate CAS Name: 3,5-bis(trifluoromethyl)benzoic acid [3-(4-fluorophenyl)-4-(phenylmethyl)-2-morpholinyl] ester IUPAC Name: [4-benzyl-3-(4-fluorophenyl)morpholin-2-yl] 3,5-bis(trifluoromethyl)benzoate Traditional Name: 3,5-bis(trifluoromethyl)benzoic acid [4-benzyl-3-(4-fluorophenyl)morpholin-2-yl] ester Formula: C26H20F7NO3 MolecularWeight: 527.430722

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(C(N1CC2=CC=CC=C2)C3=CC=C(C=C3)F)OC(=O)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1COC(C(N1CC2=CC=CC=C2)C3=CC=C(C=C3)F)OC(=O)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C26H20F7NO3/c27-21-8-6-17(7-9-21)22-24(36-11-10-34(22)15-16-4-2-1-3-5-16)37-23(35)18-12-19(25(28,29)30)14-20(13-18)26(31,32)33/h1-9,12-14,22,24H,10-11,15H2