tert-butyl N-[(1R,2S)-1-(2-bromanyl-5-oxidanyl-phenyl)-1-oxidanyl-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(1R,2S)-1-(2-bromanyl-5-oxidanyl-phenyl)-1-oxidanyl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S,2R)-2-(2-bromo-5-hydroxy-phenyl)-2-hydroxy-1-methyl-ethyl]carbamate CAS Name: N-[(1R,2S)-1-(2-bromo-5-hydroxyphenyl)-1-hydroxypropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(1R,2S)-1-(2-bromo-5-hydroxyphenyl)-1-hydroxypropan-2-yl]carbamate Traditional Name: N-[(1S,2R)-2-(2-bromo-5-hydroxy-phenyl)-2-hydroxy-1-methyl-ethyl]carbamic acid tert-butyl ester Formula: C14H20BrNO4 MolecularWeight: 346.2169

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=C(C=CC(=C1)O)Br)O)NC(=O)OC(C)(C)C

Isomeric SMILES

C[C@@H]([C@@H](C1=C(C=CC(=C1)O)Br)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C14H20BrNO4/c1-8(16-13(19)20-14(2,3)4)12(18)10-7-9(17)5-6-11(10)15/h5-8,12,17-18H,1-4H3,(H,16,19)/t8-,12-/m0/s1