(4-azanylquinazolin-2-yl)methyl 4-(4-ethanoylphenoxy)butanoate

Systemtic Name: (4-azanylquinazolin-2-yl)methyl 4-(4-ethanoylphenoxy)butanoate Openeye Name: (4-aminoquinazolin-2-yl)methyl 4-(4-acetylphenoxy)butanoate CAS Name: 4-(4-acetylphenoxy)butanoic acid (4-amino-2-quinazolinyl)methyl ester IUPAC Name: (4-aminoquinazolin-2-yl)methyl 4-(4-acetylphenoxy)butanoate Traditional Name: 4-(4-acetylphenoxy)butyric acid (4-aminoquinazolin-2-yl)methyl ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OCCCC(=O)OCC2=NC3=CC=CC=C3C(=N2)N

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OCCCC(=O)OCC2=NC3=CC=CC=C3C(=N2)N

InChI

InChI=1S/C21H21N3O4/c1-14(25)15-8-10-16(11-9-15)27-12-4-7-20(26)28-13-19-23-18-6-3-2-5-17(18)21(22)24-19/h2-3,5-6,8-11H,4,7,12-13H2,1H3,(H2,22,23,24)