(5-oxidanyl-4-oxidanylidene-7-phenylmethoxy-quinazolin-3-yl)methyl 2,2-dimethylpropanoate

Systemtic Name: (5-oxidanyl-4-oxidanylidene-7-phenylmethoxy-quinazolin-3-yl)methyl 2,2-dimethylpropanoate Openeye Name: (7-benzyloxy-5-hydroxy-4-oxo-quinazolin-3-yl)methyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid (5-hydroxy-4-oxo-7-phenylmethoxy-3-quinazolinyl)methyl ester IUPAC Name: (5-hydroxy-4-oxo-7-phenylmethoxyquinazolin-3-yl)methyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid (7-benzoxy-5-hydroxy-4-keto-quinazolin-3-yl)methyl ester Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCN1C=NC2=CC(=CC(=C2C1=O)O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C(=O)OCN1C=NC2=CC(=CC(=C2C1=O)O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H22N2O5/c1-21(2,3)20(26)28-13-23-12-22-16-9-15(10-17(24)18(16)19(23)25)27-11-14-7-5-4-6-8-14/h4-10,12,24H,11,13H2,1-3H3