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

Systemtic Name: [5-(1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methyl 3-(4-oxidanylidenequinazolin-3-yl)propanoate Openeye Name: [5-(1,3-benzodioxol-5-yl)isoxazol-3-yl]methyl 3-(4-oxoquinazolin-3-yl)propanoate CAS Name: 3-(4-oxo-3-quinazolinyl)propanoic acid [5-(1,3-benzodioxol-5-yl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methyl 3-(4-oxoquinazolin-3-yl)propanoate Traditional Name: 3-(4-ketoquinazolin-3-yl)propionic acid [5-(1,3-benzodioxol-5-yl)isoxazol-3-yl]methyl ester Formula: C22H17N3O6 MolecularWeight: 419.38688

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CC(=NO3)COC(=O)CCN4C=NC5=CC=CC=C5C4=O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CC(=NO3)COC(=O)CCN4C=NC5=CC=CC=C5C4=O

InChI

InChI=1S/C22H17N3O6/c26-21(7-8-25-12-23-17-4-2-1-3-16(17)22(25)27)28-11-15-10-19(31-24-15)14-5-6-18-20(9-14)30-13-29-18/h1-6,9-10,12H,7-8,11,13H2