2-[[3-[(7-chloranylquinolin-2-yl)methoxy]phenoxy]methyl]-6-methyl-benzoic acid

Systemtic Name: 2-[[3-[(7-chloranylquinolin-2-yl)methoxy]phenoxy]methyl]-6-methyl-benzoic acid Openeye Name: 2-[[3-[(7-chloro-2-quinolyl)methoxy]phenoxy]methyl]-6-methyl-benzoic acid CAS Name: 2-[[3-[(7-chloro-2-quinolinyl)methoxy]phenoxy]methyl]-6-methylbenzoic acid IUPAC Name: 2-[[3-[(7-chloroquinolin-2-yl)methoxy]phenoxy]methyl]-6-methylbenzoic acid Traditional Name: 2-[[3-[(7-chloro-2-quinolyl)methoxy]phenoxy]methyl]-6-methyl-benzoic acid Formula: C25H20ClNO4 MolecularWeight: 433.8836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)COC2=CC(=CC=C2)OCC3=NC4=C(C=CC(=C4)Cl)C=C3)C(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)COC2=CC(=CC=C2)OCC3=NC4=C(C=CC(=C4)Cl)C=C3)C(=O)O

InChI

InChI=1S/C25H20ClNO4/c1-16-4-2-5-18(24(16)25(28)29)14-30-21-6-3-7-22(13-21)31-15-20-11-9-17-8-10-19(26)12-23(17)27-20/h2-13H,14-15H2,1H3,(H,28,29)