3-[3-(2-bromanylpyridin-3-yl)oxypropoxy]-2-oxidanyl-3-phenyl-2-propan-2-yloxy-propanoic acid

Systemtic Name: 3-[3-(2-bromanylpyridin-3-yl)oxypropoxy]-2-oxidanyl-3-phenyl-2-propan-2-yloxy-propanoic acid Openeye Name: 3-[3-[(2-bromo-3-pyridyl)oxy]propoxy]-2-hydroxy-2-isopropoxy-3-phenyl-propanoic acid CAS Name: 3-[3-[(2-bromo-3-pyridinyl)oxy]propoxy]-2-hydroxy-3-phenyl-2-propan-2-yloxypropanoic acid IUPAC Name: 3-[3-(2-bromopyridin-3-yl)oxypropoxy]-2-hydroxy-3-phenyl-2-propan-2-yloxypropanoic acid Traditional Name: 3-[3-[(2-bromo-3-pyridyl)oxy]propoxy]-2-hydroxy-2-isopropoxy-3-phenyl-propionic acid Formula: C20H24BrNO6 MolecularWeight: 454.31166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(C(C1=CC=CC=C1)OCCCOC2=C(N=CC=C2)Br)(C(=O)O)O

Isomeric SMILES

CC(C)OC(C(C1=CC=CC=C1)OCCCOC2=C(N=CC=C2)Br)(C(=O)O)O

InChI

InChI=1S/C20H24BrNO6/c1-14(2)28-20(25,19(23)24)17(15-8-4-3-5-9-15)27-13-7-12-26-16-10-6-11-22-18(16)21/h3-6,8-11,14,17,25H,7,12-13H2,1-2H3,(H,23,24)