2-[[4-[4-(4-azanylcyclohexyl)oxyphenoxy]phenyl]carbonylamino]benzoic acid

Systemtic Name: 2-[[4-[4-(4-azanylcyclohexyl)oxyphenoxy]phenyl]carbonylamino]benzoic acid Openeye Name: 2-[[4-[4-(4-aminocyclohexoxy)phenoxy]benzoyl]amino]benzoic acid CAS Name: 2-[[[4-[4-(4-aminocyclohexyl)oxyphenoxy]phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 2-[[4-[4-(4-aminocyclohexyl)oxyphenoxy]benzoyl]amino]benzoic acid Traditional Name: 2-[[4-[4-(4-aminocyclohexoxy)phenoxy]benzoyl]amino]benzoic acid Formula: C26H26N2O5 MolecularWeight: 446.49504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)OC2=CC=C(C=C2)OC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4C(=O)O

Isomeric SMILES

C1CC(CCC1N)OC2=CC=C(C=C2)OC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C26H26N2O5/c27-18-7-11-20(12-8-18)33-22-15-13-21(14-16-22)32-19-9-5-17(6-10-19)25(29)28-24-4-2-1-3-23(24)26(30)31/h1-6,9-10,13-16,18,20H,7-8,11-12,27H2,(H,28,29)(H,30,31)