[6-methoxy-4-oxidanylidene-7-(piperidin-4-ylmethoxy)quinazolin-3-yl]methyl 2,2-dimethylpropanoate

Systemtic Name: [6-methoxy-4-oxidanylidene-7-(piperidin-4-ylmethoxy)quinazolin-3-yl]methyl 2,2-dimethylpropanoate Openeye Name: [6-methoxy-4-oxo-7-(4-piperidylmethoxy)quinazolin-3-yl]methyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [6-methoxy-4-oxo-7-(4-piperidinylmethoxy)-3-quinazolinyl]methyl ester IUPAC Name: [6-methoxy-4-oxo-7-(piperidin-4-ylmethoxy)quinazolin-3-yl]methyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [4-keto-6-methoxy-7-(4-piperidylmethoxy)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=CC(=C(C=C2C1=O)OC)OCC3CCNCC3

Isomeric SMILES

CC(C)(C)C(=O)OCN1C=NC2=CC(=C(C=C2C1=O)OC)OCC3CCNCC3

InChI

InChI=1S/C21H29N3O5/c1-21(2,3)20(26)29-13-24-12-23-16-10-18(17(27-4)9-15(16)19(24)25)28-11-14-5-7-22-8-6-14/h9-10,12,14,22H,5-8,11,13H2,1-4H3