2-[5-[2,4-bis(bromanyl)phenoxy]-2-nitro-phenoxy]propanoic acid

Systemtic Name: 2-[5-[2,4-bis(bromanyl)phenoxy]-2-nitro-phenoxy]propanoic acid Openeye Name: 2-[5-(2,4-dibromophenoxy)-2-nitro-phenoxy]propanoic acid CAS Name: 2-[5-(2,4-dibromophenoxy)-2-nitrophenoxy]propanoic acid IUPAC Name: 2-[5-(2,4-dibromophenoxy)-2-nitrophenoxy]propanoic acid Traditional Name: 2-[5-(2,4-dibromophenoxy)-2-nitro-phenoxy]propionic acid Formula: C15H11Br2NO6 MolecularWeight: 461.05894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OC1=C(C=CC(=C1)OC2=C(C=C(C=C2)Br)Br)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)O)OC1=C(C=CC(=C1)OC2=C(C=C(C=C2)Br)Br)[N+](=O)[O-]

InChI

InChI=1S/C15H11Br2NO6/c1-8(15(19)20)23-14-7-10(3-4-12(14)18(21)22)24-13-5-2-9(16)6-11(13)17/h2-8H,1H3,(H,19,20)