2-[(5-bromanyl-2-oxidanyl-phenyl)methyl-[2-[(5-bromanyl-2-oxidanyl-phenyl)methyl-(carboxymethyl)amino]ethyl]amino]ethanoic acid

Systemtic Name: 2-[(5-bromanyl-2-oxidanyl-phenyl)methyl-[2-[(5-bromanyl-2-oxidanyl-phenyl)methyl-(carboxymethyl)amino]ethyl]amino]ethanoic acid Openeye Name: 2-[(5-bromo-2-hydroxy-phenyl)methyl-[2-[(5-bromo-2-hydroxy-phenyl)methyl-(carboxymethyl)amino]ethyl]amino]acetic acid CAS Name: 2-[(5-bromo-2-hydroxyphenyl)methyl-[2-[(5-bromo-2-hydroxyphenyl)methyl-(carboxymethyl)amino]ethyl]amino]acetic acid IUPAC Name: 2-[(5-bromo-2-hydroxyphenyl)methyl-[2-[(5-bromo-2-hydroxyphenyl)methyl-(carboxymethyl)amino]ethyl]amino]acetic acid Traditional Name: 2-[(5-bromo-2-hydroxy-benzyl)-[2-[(5-bromo-2-hydroxy-benzyl)-(carboxymethyl)amino]ethyl]amino]acetic acid Formula: C20H22Br2N2O6 MolecularWeight: 546.20648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)CN(CCN(CC2=C(C=CC(=C2)Br)O)CC(=O)O)CC(=O)O)O

Isomeric SMILES

C1=CC(=C(C=C1Br)CN(CCN(CC2=C(C=CC(=C2)Br)O)CC(=O)O)CC(=O)O)O

InChI

InChI=1S/C20H22Br2N2O6/c21-15-1-3-17(25)13(7-15)9-23(11-19(27)28)5-6-24(12-20(29)30)10-14-8-16(22)2-4-18(14)26/h1-4,7-8,25-26H,5-6,9-12H2,(H,27,28)(H,29,30)