[7-(3-morpholin-4-ylpropoxy)-4-oxidanylidene-quinazolin-3-yl]methyl 2,2-dimethylpropanoate

Systemtic Name: [7-(3-morpholin-4-ylpropoxy)-4-oxidanylidene-quinazolin-3-yl]methyl 2,2-dimethylpropanoate Openeye Name: [7-(3-morpholinopropoxy)-4-oxo-quinazolin-3-yl]methyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [7-[3-(4-morpholinyl)propoxy]-4-oxo-3-quinazolinyl]methyl ester IUPAC Name: [7-(3-morpholin-4-ylpropoxy)-4-oxoquinazolin-3-yl]methyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [4-keto-7-(3-morpholinopropoxy)quinazolin-3-yl]methyl ester Formula: C21H29N3O5 MolecularWeight: 403.47206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCN1C=NC2=C(C1=O)C=CC(=C2)OCCCN3CCOCC3

Isomeric SMILES

CC(C)(C)C(=O)OCN1C=NC2=C(C1=O)C=CC(=C2)OCCCN3CCOCC3

InChI

InChI=1S/C21H29N3O5/c1-21(2,3)20(26)29-15-24-14-22-18-13-16(5-6-17(18)19(24)25)28-10-4-7-23-8-11-27-12-9-23/h5-6,13-14H,4,7-12,15H2,1-3H3