tert-butyl (2S,4S)-2-[(3-bromanyl-4-chloranyl-phenyl)carbamoyl]-4-oxidanyl-pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S,4S)-2-[(3-bromanyl-4-chloranyl-phenyl)carbamoyl]-4-oxidanyl-pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S,4S)-2-[(3-bromo-4-chloro-phenyl)carbamoyl]-4-hydroxy-pyrrolidine-1-carboxylate CAS Name: (2S,4S)-2-[(3-bromo-4-chloroanilino)-oxomethyl]-4-hydroxy-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,4S)-2-[(3-bromo-4-chlorophenyl)carbamoyl]-4-hydroxypyrrolidine-1-carboxylate Traditional Name: (2S,4S)-2-[(3-bromo-4-chloro-phenyl)carbamoyl]-4-hydroxy-pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C16H20BrClN2O4 MolecularWeight: 419.698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)NC2=CC(=C(C=C2)Cl)Br)O

Isomeric SMILES

CC(C)(C)OC(=O)N1C[C@H](C[C@H]1C(=O)NC2=CC(=C(C=C2)Cl)Br)O

InChI

InChI=1S/C16H20BrClN2O4/c1-16(2,3)24-15(23)20-8-10(21)7-13(20)14(22)19-9-4-5-12(18)11(17)6-9/h4-6,10,13,21H,7-8H2,1-3H3,(H,19,22)/t10-,13-/m0/s1