tert-butyl (1R,4R,5S)-4-methyl-5-phenyl-3-azabicyclo[3.1.0]hexane-3-carboxylate

Systemtic Name: tert-butyl (1R,4R,5S)-4-methyl-5-phenyl-3-azabicyclo[3.1.0]hexane-3-carboxylate Openeye Name: tert-butyl (1R,4R,5S)-4-methyl-5-phenyl-3-azabicyclo[3.1.0]hexane-3-carboxylate CAS Name: (1R,4R,5S)-4-methyl-5-phenyl-3-azabicyclo[3.1.0]hexane-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (1R,4R,5S)-4-methyl-5-phenyl-3-azabicyclo[3.1.0]hexane-3-carboxylate Traditional Name: (1R,4R,5S)-4-methyl-5-phenyl-3-azabicyclo[3.1.0]hexane-3-carboxylic acid tert-butyl ester Formula: C17H23NO2 MolecularWeight: 273.37002

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2(CC2CN1C(=O)OC(C)(C)C)C3=CC=CC=C3

Isomeric SMILES

C[C@@H]1[C@]2(C[C@H]2CN1C(=O)OC(C)(C)C)C3=CC=CC=C3

InChI

InChI=1S/C17H23NO2/c1-12-17(13-8-6-5-7-9-13)10-14(17)11-18(12)15(19)20-16(2,3)4/h5-9,12,14H,10-11H2,1-4H3/t12-,14+,17-/m1/s1