[(2S)-1-(4-tert-butylphenoxy)-3-morpholin-4-yl-propan-2-yl] 4-fluoranylbenzoate

Systemtic Name: [(2S)-1-(4-tert-butylphenoxy)-3-morpholin-4-yl-propan-2-yl] 4-fluoranylbenzoate Openeye Name: [(1S)-1-[(4-tert-butylphenoxy)methyl]-2-morpholino-ethyl] 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid [(2S)-1-(4-tert-butylphenoxy)-3-(4-morpholinyl)propan-2-yl] ester IUPAC Name: [(2S)-1-(4-tert-butylphenoxy)-3-morpholin-4-ylpropan-2-yl] 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid [(1S)-1-[(4-tert-butylphenoxy)methyl]-2-morpholino-ethyl] ester Formula: C24H30FNO4 MolecularWeight: 415.497703

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC(CN2CCOCC2)OC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OC[C@H](CN2CCOCC2)OC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C24H30FNO4/c1-24(2,3)19-6-10-21(11-7-19)29-17-22(16-26-12-14-28-15-13-26)30-23(27)18-4-8-20(25)9-5-18/h4-11,22H,12-17H2,1-3H3/t22-/m0/s1