3-[4-[2-[(5-chloranyl-3-phenoxy-pyridin-2-yl)amino]ethoxy]-2-methyl-phenyl]propanoic acid

Systemtic Name: 3-[4-[2-[(5-chloranyl-3-phenoxy-pyridin-2-yl)amino]ethoxy]-2-methyl-phenyl]propanoic acid Openeye Name: 3-[4-[2-[(5-chloro-3-phenoxy-2-pyridyl)amino]ethoxy]-2-methyl-phenyl]propanoic acid CAS Name: 3-[4-[2-[(5-chloro-3-phenoxy-2-pyridinyl)amino]ethoxy]-2-methylphenyl]propanoic acid IUPAC Name: 3-[4-[2-[(5-chloro-3-phenoxypyridin-2-yl)amino]ethoxy]-2-methylphenyl]propanoic acid Traditional Name: 3-[4-[2-[(5-chloro-3-phenoxy-2-pyridyl)amino]ethoxy]-2-methyl-phenyl]propionic acid Formula: C23H23ClN2O4 MolecularWeight: 426.89272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCNC2=NC=C(C=C2OC3=CC=CC=C3)Cl)CCC(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)OCCNC2=NC=C(C=C2OC3=CC=CC=C3)Cl)CCC(=O)O

InChI

InChI=1S/C23H23ClN2O4/c1-16-13-20(9-7-17(16)8-10-22(27)28)29-12-11-25-23-21(14-18(24)15-26-23)30-19-5-3-2-4-6-19/h2-7,9,13-15H,8,10-12H2,1H3,(H,25,26)(H,27,28)