3,4-bis[2-(4-bromanylphenoxy)ethanoylamino]benzoic acid

Systemtic Name: 3,4-bis[2-(4-bromanylphenoxy)ethanoylamino]benzoic acid Openeye Name: 3,4-bis[[2-(4-bromophenoxy)acetyl]amino]benzoic acid CAS Name: 3,4-bis[[2-(4-bromophenoxy)-1-oxoethyl]amino]benzoic acid IUPAC Name: 3,4-bis[[2-(4-bromophenoxy)acetyl]amino]benzoic acid Traditional Name: 3,4-bis[[2-(4-bromophenoxy)acetyl]amino]benzoic acid Formula: C23H18Br2N2O6 MolecularWeight: 578.20682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCC(=O)NC2=C(C=C(C=C2)C(=O)O)NC(=O)COC3=CC=C(C=C3)Br)Br

Isomeric SMILES

C1=CC(=CC=C1OCC(=O)NC2=C(C=C(C=C2)C(=O)O)NC(=O)COC3=CC=C(C=C3)Br)Br

InChI

InChI=1S/C23H18Br2N2O6/c24-15-2-6-17(7-3-15)32-12-21(28)26-19-10-1-14(23(30)31)11-20(19)27-22(29)13-33-18-8-4-16(25)5-9-18/h1-11H,12-13H2,(H,26,28)(H,27,29)(H,30,31)