tert-butyl 3-[3,5-bis(bromanyl)phenyl]-3-oxidanyl-propanoate

Systemtic Name: tert-butyl 3-[3,5-bis(bromanyl)phenyl]-3-oxidanyl-propanoate Openeye Name: tert-butyl 3-(3,5-dibromophenyl)-3-hydroxy-propanoate CAS Name: 3-(3,5-dibromophenyl)-3-hydroxypropanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-(3,5-dibromophenyl)-3-hydroxypropanoate Traditional Name: 3-(3,5-dibromophenyl)-3-hydroxy-propionic acid tert-butyl ester Formula: C13H16Br2O3 MolecularWeight: 380.07234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16Br2O3/c1-13(2,3)18-12(17)7-11(16)8-4-9(14)6-10(15)5-8/h4-6,11,16H,7H2,1-3H3