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

Systemtic Name: [5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl 3-(4-oxidanylidenequinazolin-3-yl)propanoate Openeye Name: [5-(3,4-dimethoxyphenyl)isoxazol-3-yl]methyl 3-(4-oxoquinazolin-3-yl)propanoate CAS Name: 3-(4-oxo-3-quinazolinyl)propanoic acid [5-(3,4-dimethoxyphenyl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl 3-(4-oxoquinazolin-3-yl)propanoate Traditional Name: 3-(4-ketoquinazolin-3-yl)propionic acid [5-(3,4-dimethoxyphenyl)isoxazol-3-yl]methyl ester Formula: C23H21N3O6 MolecularWeight: 435.42934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21N3O6/c1-29-19-8-7-15(11-21(19)30-2)20-12-16(25-32-20)13-31-22(27)9-10-26-14-24-18-6-4-3-5-17(18)23(26)28/h3-8,11-12,14H,9-10,13H2,1-2H3