(4-tert-butylphenyl)methyl 2-(4-oxidanylidenequinazolin-3-yl)ethanoate

Systemtic Name: (4-tert-butylphenyl)methyl 2-(4-oxidanylidenequinazolin-3-yl)ethanoate Openeye Name: (4-tert-butylphenyl)methyl 2-(4-oxoquinazolin-3-yl)acetate CAS Name: 2-(4-oxo-3-quinazolinyl)acetic acid (4-tert-butylphenyl)methyl ester IUPAC Name: (4-tert-butylphenyl)methyl 2-(4-oxoquinazolin-3-yl)acetate Traditional Name: 2-(4-ketoquinazolin-3-yl)acetic acid (4-tert-butylbenzyl) ester Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)COC(=O)CN2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)COC(=O)CN2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C21H22N2O3/c1-21(2,3)16-10-8-15(9-11-16)13-26-19(24)12-23-14-22-18-7-5-4-6-17(18)20(23)25/h4-11,14H,12-13H2,1-3H3