2-[4-[(6-chloranyl-4H-1,3-benzodioxin-5-yl)methylamino]phenoxy]-2-phenyl-ethanoic acid

Systemtic Name: 2-[4-[(6-chloranyl-4H-1,3-benzodioxin-5-yl)methylamino]phenoxy]-2-phenyl-ethanoic acid Openeye Name: 2-[4-[(6-chloro-4H-1,3-benzodioxin-5-yl)methylamino]phenoxy]-2-phenyl-acetic acid CAS Name: 2-[4-[(6-chloro-4H-1,3-benzodioxin-5-yl)methylamino]phenoxy]-2-phenylacetic acid IUPAC Name: 2-[4-[(6-chloro-4H-1,3-benzodioxin-5-yl)methylamino]phenoxy]-2-phenylacetic acid Traditional Name: 2-[4-[(6-chloro-4H-1,3-benzodioxin-5-yl)methylamino]phenoxy]-2-phenyl-acetic acid Formula: C23H20ClNO5 MolecularWeight: 425.8616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2CNC3=CC=C(C=C3)OC(C4=CC=CC=C4)C(=O)O)Cl)OCO1

Isomeric SMILES

C1C2=C(C=CC(=C2CNC3=CC=C(C=C3)OC(C4=CC=CC=C4)C(=O)O)Cl)OCO1

InChI

InChI=1S/C23H20ClNO5/c24-20-10-11-21-19(13-28-14-29-21)18(20)12-25-16-6-8-17(9-7-16)30-22(23(26)27)15-4-2-1-3-5-15/h1-11,22,25H,12-14H2,(H,26,27)