4-cyano-2-[[2-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]-6-oxidanylidene-5H-pyrimido[4,5-b][1,4]oxazin-4-yl]oxy]benzoic acid

Systemtic Name: 4-cyano-2-[[2-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]-6-oxidanylidene-5H-pyrimido[4,5-b][1,4]oxazin-4-yl]oxy]benzoic acid Openeye Name: 4-cyano-2-[[2-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]-6-oxo-5H-pyrimido[4,5-b][1,4]oxazin-4-yl]oxy]benzoic acid CAS Name: 4-cyano-2-[[2-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]-6-oxo-5H-pyrimido[4,5-b][1,4]oxazin-4-yl]oxy]benzoic acid IUPAC Name: 4-cyano-2-[[2-[3-(1-methyl-4,5-dihydroimidazol-2-yl)phenoxy]-6-oxo-5H-pyrimido[4,5-b][1,4]oxazin-4-yl]oxy]benzoic acid Traditional Name: 4-cyano-2-[[6-keto-2-[3-(1-methyl-2-imidazolin-2-yl)phenoxy]-5H-pyrimido[4,5-b][1,4]oxazin-4-yl]oxy]benzoic acid Formula: C24H18N6O6 MolecularWeight: 486.43632

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN=C1C2=CC(=CC=C2)OC3=NC4=C(C(=N3)OC5=C(C=CC(=C5)C#N)C(=O)O)NC(=O)CO4

Isomeric SMILES

CN1CCN=C1C2=CC(=CC=C2)OC3=NC4=C(C(=N3)OC5=C(C=CC(=C5)C#N)C(=O)O)NC(=O)CO4

InChI

InChI=1S/C24H18N6O6/c1-30-8-7-26-20(30)14-3-2-4-15(10-14)35-24-28-21-19(27-18(31)12-34-21)22(29-24)36-17-9-13(11-25)5-6-16(17)23(32)33/h2-6,9-10H,7-8,12H2,1H3,(H,27,31)(H,32,33)