2-(2,2-dimethylbutanoyl)-7-(3-morpholin-4-ylpropoxy)-1H-quinazolin-4-one

Systemtic Name: 2-(2,2-dimethylbutanoyl)-7-(3-morpholin-4-ylpropoxy)-1H-quinazolin-4-one Openeye Name: 2-(2,2-dimethylbutanoyl)-7-(3-morpholinopropoxy)-1H-quinazolin-4-one CAS Name: 2-(2,2-dimethyl-1-oxobutyl)-7-[3-(4-morpholinyl)propoxy]-1H-quinazolin-4-one IUPAC Name: 2-(2,2-dimethylbutanoyl)-7-(3-morpholin-4-ylpropoxy)-1H-quinazolin-4-one Traditional Name: 2-(2,2-dimethylbutanoyl)-7-(3-morpholinopropoxy)-1H-quinazolin-4-one Formula: C21H29N3O4 MolecularWeight: 387.47266

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)C1=NC(=O)C2=C(N1)C=C(C=C2)OCCCN3CCOCC3

Isomeric SMILES

CCC(C)(C)C(=O)C1=NC(=O)C2=C(N1)C=C(C=C2)OCCCN3CCOCC3

InChI

InChI=1S/C21H29N3O4/c1-4-21(2,3)18(25)19-22-17-14-15(6-7-16(17)20(26)23-19)28-11-5-8-24-9-12-27-13-10-24/h6-7,14H,4-5,8-13H2,1-3H3,(H,22,23,26)