3-chloranyl-4-[4-[(4-phenoxyphenyl)methylamino]phenoxy]benzoic acid

Systemtic Name: 3-chloranyl-4-[4-[(4-phenoxyphenyl)methylamino]phenoxy]benzoic acid Openeye Name: 3-chloro-4-[4-[(4-phenoxyphenyl)methylamino]phenoxy]benzoic acid CAS Name: 3-chloro-4-[4-[(4-phenoxyphenyl)methylamino]phenoxy]benzoic acid IUPAC Name: 3-chloro-4-[4-[(4-phenoxyphenyl)methylamino]phenoxy]benzoic acid Traditional Name: 3-chloro-4-[4-[(4-phenoxybenzyl)amino]phenoxy]benzoic acid Formula: C26H20ClNO4 MolecularWeight: 445.8943

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)CNC3=CC=C(C=C3)OC4=C(C=C(C=C4)C(=O)O)Cl

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)CNC3=CC=C(C=C3)OC4=C(C=C(C=C4)C(=O)O)Cl

InChI

InChI=1S/C26H20ClNO4/c27-24-16-19(26(29)30)8-15-25(24)32-23-13-9-20(10-14-23)28-17-18-6-11-22(12-7-18)31-21-4-2-1-3-5-21/h1-16,28H,17H2,(H,29,30)