[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]methyl 3-(4-oxidanylidenequinazolin-3-yl)propanoate

Systemtic Name: [5-(4-methoxyphenyl)-1,2-oxazol-3-yl]methyl 3-(4-oxidanylidenequinazolin-3-yl)propanoate Openeye Name: [5-(4-methoxyphenyl)isoxazol-3-yl]methyl 3-(4-oxoquinazolin-3-yl)propanoate CAS Name: 3-(4-oxo-3-quinazolinyl)propanoic acid [5-(4-methoxyphenyl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(4-methoxyphenyl)-1,2-oxazol-3-yl]methyl 3-(4-oxoquinazolin-3-yl)propanoate Traditional Name: 3-(4-ketoquinazolin-3-yl)propionic acid [5-(4-methoxyphenyl)isoxazol-3-yl]methyl ester Formula: C22H19N3O5 MolecularWeight: 405.40336

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NO2)COC(=O)CCN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NO2)COC(=O)CCN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C22H19N3O5/c1-28-17-8-6-15(7-9-17)20-12-16(24-30-20)13-29-21(26)10-11-25-14-23-19-5-3-2-4-18(19)22(25)27/h2-9,12,14H,10-11,13H2,1H3