4-[[6-[2-(4-methoxyphenyl)ethanoyloxy]-4-oxidanylidene-quinazolin-3-yl]methyl]benzoic acid

Systemtic Name: 4-[[6-[2-(4-methoxyphenyl)ethanoyloxy]-4-oxidanylidene-quinazolin-3-yl]methyl]benzoic acid Openeye Name: 4-[[6-[2-(4-methoxyphenyl)acetyl]oxy-4-oxo-quinazolin-3-yl]methyl]benzoic acid CAS Name: 4-[[6-[2-(4-methoxyphenyl)-1-oxoethoxy]-4-oxo-3-quinazolinyl]methyl]benzoic acid IUPAC Name: 4-[[6-[2-(4-methoxyphenyl)acetyl]oxy-4-oxoquinazolin-3-yl]methyl]benzoic acid Traditional Name: 4-[[4-keto-6-[2-(4-methoxyphenyl)acetyl]oxy-quinazolin-3-yl]methyl]benzoic acid Formula: C25H20N2O6 MolecularWeight: 444.4361

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(=O)OC2=CC3=C(C=C2)N=CN(C3=O)CC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)CC(=O)OC2=CC3=C(C=C2)N=CN(C3=O)CC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C25H20N2O6/c1-32-19-8-4-16(5-9-19)12-23(28)33-20-10-11-22-21(13-20)24(29)27(15-26-22)14-17-2-6-18(7-3-17)25(30)31/h2-11,13,15H,12,14H2,1H3,(H,30,31)