[(1S)-1-[(2R,4S)-2-tert-butyl-1-methyl-5-oxidanylidene-imidazolidin-4-yl]-2-fluoranyl-ethyl] benzoate

Systemtic Name: [(1S)-1-[(2R,4S)-2-tert-butyl-1-methyl-5-oxidanylidene-imidazolidin-4-yl]-2-fluoranyl-ethyl] benzoate Openeye Name: [(1S)-1-[(2R,4S)-2-tert-butyl-1-methyl-5-oxo-imidazolidin-4-yl]-2-fluoro-ethyl] benzoate CAS Name: benzoic acid [(1S)-1-[(2R,4S)-2-tert-butyl-1-methyl-5-oxo-4-imidazolidinyl]-2-fluoroethyl] ester IUPAC Name: [(1S)-1-[(2R,4S)-2-tert-butyl-1-methyl-5-oxoimidazolidin-4-yl]-2-fluoroethyl] benzoate Traditional Name: benzoic acid [(1S)-1-[(2R,4S)-2-tert-butyl-5-keto-1-methyl-imidazolidin-4-yl]-2-fluoro-ethyl] ester Formula: C17H23FN2O3 MolecularWeight: 322.374523

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1NC(C(=O)N1C)C(CF)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)[C@@H]1N[C@H](C(=O)N1C)[C@@H](CF)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H23FN2O3/c1-17(2,3)16-19-13(14(21)20(16)4)12(10-18)23-15(22)11-8-6-5-7-9-11/h5-9,12-13,16,19H,10H2,1-4H3/t12-,13+,16-/m1/s1