2-methyl-6-[[3-[(3-methyl-4-oxidanylidene-quinazolin-2-yl)methoxy]phenoxy]methyl]benzoic acid

Systemtic Name: 2-methyl-6-[[3-[(3-methyl-4-oxidanylidene-quinazolin-2-yl)methoxy]phenoxy]methyl]benzoic acid Openeye Name: 2-methyl-6-[[3-[(3-methyl-4-oxo-quinazolin-2-yl)methoxy]phenoxy]methyl]benzoic acid CAS Name: 2-methyl-6-[[3-[(3-methyl-4-oxo-2-quinazolinyl)methoxy]phenoxy]methyl]benzoic acid IUPAC Name: 2-methyl-6-[[3-[(3-methyl-4-oxoquinazolin-2-yl)methoxy]phenoxy]methyl]benzoic acid Traditional Name: 2-[[3-[(4-keto-3-methyl-quinazolin-2-yl)methoxy]phenoxy]methyl]-6-methyl-benzoic acid Formula: C25H22N2O5 MolecularWeight: 430.45258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)COC2=CC(=CC=C2)OCC3=NC4=CC=CC=C4C(=O)N3C)C(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)COC2=CC(=CC=C2)OCC3=NC4=CC=CC=C4C(=O)N3C)C(=O)O

InChI

InChI=1S/C25H22N2O5/c1-16-7-5-8-17(23(16)25(29)30)14-31-18-9-6-10-19(13-18)32-15-22-26-21-12-4-3-11-20(21)24(28)27(22)2/h3-13H,14-15H2,1-2H3,(H,29,30)