2-azanyl-5-[4-[4-(4-azanyl-3-carboxy-phenoxy)phenyl]phenoxy]benzoic acid

Systemtic Name: 2-azanyl-5-[4-[4-(4-azanyl-3-carboxy-phenoxy)phenyl]phenoxy]benzoic acid Openeye Name: 2-amino-5-[4-[4-(4-amino-3-carboxy-phenoxy)phenyl]phenoxy]benzoic acid CAS Name: 2-amino-5-[4-[4-(4-amino-3-carboxyphenoxy)phenyl]phenoxy]benzoic acid IUPAC Name: 2-amino-5-[4-[4-(4-amino-3-carboxyphenoxy)phenyl]phenoxy]benzoic acid Traditional Name: 2-amino-5-[4-[4-(4-amino-3-carboxy-phenoxy)phenyl]phenoxy]benzoic acid Formula: C26H20N2O6 MolecularWeight: 456.4468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(C=C2)OC3=CC(=C(C=C3)N)C(=O)O)OC4=CC(=C(C=C4)N)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(C=C2)OC3=CC(=C(C=C3)N)C(=O)O)OC4=CC(=C(C=C4)N)C(=O)O

InChI

InChI=1S/C26H20N2O6/c27-23-11-9-19(13-21(23)25(29)30)33-17-5-1-15(2-6-17)16-3-7-18(8-4-16)34-20-10-12-24(28)22(14-20)26(31)32/h1-14H,27-28H2,(H,29,30)(H,31,32)