(2S,4S)-4-(4-bromo-2-chlorophenoxy)-1-(tert-butoxycarbonyl)pyrrolidine-2-carboxylic acid

CAS: 1354485-75-8

Formula: C16H19BrClNO5

SMILES: CC(C)(C)OC(=O)N1C[C@H](C[C@H]1C(O)=O)OC1=C(Cl)C=C(Br)C=C1

IUPAC: (2S,4S)-4-(4-bromo-2-chlorophenoxy)-1-[(tert-butoxy)carbonyl]pyrrolidine-2-carboxylic acid

InChI: InChI=1S/C16H19BrClNO5/c1-16(2,3)24-15(22)19-8-10(7-12(19)14(20)21)23-13-5-4-9(17)6-11(13)18/h4-6,10,12H,7-8H2,1-3H3,(H,20,21)/t10-,12-/m0/s1

Composition: C (45.68%), H (4.55%), Br (18.99%), Cl (8.43%), N (3.33%), O (19.02%)

Molar Mass: 420.68

Atom Count: 43

Heavy Atom Count: 24