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

Systemtic Name: 2-methyl-6-[[3-[(3-methylquinoxalin-2-yl)methoxy]phenoxy]methyl]benzoic acid Openeye Name: 2-methyl-6-[[3-[(3-methylquinoxalin-2-yl)methoxy]phenoxy]methyl]benzoic acid CAS Name: 2-methyl-6-[[3-[(3-methyl-2-quinoxalinyl)methoxy]phenoxy]methyl]benzoic acid IUPAC Name: 2-methyl-6-[[3-[(3-methylquinoxalin-2-yl)methoxy]phenoxy]methyl]benzoic acid Traditional Name: 2-methyl-6-[[3-[(3-methylquinoxalin-2-yl)methoxy]phenoxy]methyl]benzoic acid Formula: C25H22N2O4 MolecularWeight: 414.45318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)COC2=CC(=CC=C2)OCC3=NC4=CC=CC=C4N=C3C)C(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)COC2=CC(=CC=C2)OCC3=NC4=CC=CC=C4N=C3C)C(=O)O

InChI

InChI=1S/C25H22N2O4/c1-16-7-5-8-18(24(16)25(28)29)14-30-19-9-6-10-20(13-19)31-15-23-17(2)26-21-11-3-4-12-22(21)27-23/h3-13H,14-15H2,1-2H3,(H,28,29)