(4-acetamidophenyl) 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanoate

Systemtic Name: (4-acetamidophenyl) 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanoate Openeye Name: (4-acetamidophenyl) 3-(6-bromo-4-oxo-quinazolin-3-yl)propanoate CAS Name: 3-(6-bromo-4-oxo-3-quinazolinyl)propanoic acid (4-acetamidophenyl) ester IUPAC Name: (4-acetamidophenyl) 3-(6-bromo-4-oxoquinazolin-3-yl)propanoate Traditional Name: 3-(6-bromo-4-keto-quinazolin-3-yl)propionic acid (4-acetamidophenyl) ester Formula: C19H16BrN3O4 MolecularWeight: 430.25204

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)OC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)OC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C19H16BrN3O4/c1-12(24)22-14-3-5-15(6-4-14)27-18(25)8-9-23-11-21-17-7-2-13(20)10-16(17)19(23)26/h2-7,10-11H,8-9H2,1H3,(H,22,24)