tert-butyl 3-[3-bromanyl-5-chloranyl-2-(2-methoxyethoxymethoxy)phenyl]-3-[(2-oxidanyl-1-phenyl-ethyl)amino]propanoate

Systemtic Name: tert-butyl 3-[3-bromanyl-5-chloranyl-2-(2-methoxyethoxymethoxy)phenyl]-3-[(2-oxidanyl-1-phenyl-ethyl)amino]propanoate Openeye Name: tert-butyl 3-[3-bromo-5-chloro-2-(2-methoxyethoxymethoxy)phenyl]-3-[(2-hydroxy-1-phenyl-ethyl)amino]propanoate CAS Name: 3-[3-bromo-5-chloro-2-(2-methoxyethoxymethoxy)phenyl]-3-[(2-hydroxy-1-phenylethyl)amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[3-bromo-5-chloro-2-(2-methoxyethoxymethoxy)phenyl]-3-[(2-hydroxy-1-phenylethyl)amino]propanoate Traditional Name: 3-[3-bromo-5-chloro-2-(2-methoxyethoxymethoxy)phenyl]-3-[(2-hydroxy-1-phenyl-ethyl)amino]propionic acid tert-butyl ester Formula: C25H33BrClNO6 MolecularWeight: 558.88962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(C1=CC(=CC(=C1OCOCCOC)Br)Cl)NC(CO)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)CC(C1=CC(=CC(=C1OCOCCOC)Br)Cl)NC(CO)C2=CC=CC=C2

InChI

InChI=1S/C25H33BrClNO6/c1-25(2,3)34-23(30)14-21(28-22(15-29)17-8-6-5-7-9-17)19-12-18(27)13-20(26)24(19)33-16-32-11-10-31-4/h5-9,12-13,21-22,28-29H,10-11,14-16H2,1-4H3