3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)butanoic acid

Systemtic Name: 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)butanoic acid Openeye Name: 3-(6-bromo-4-oxo-quinazolin-3-yl)butanoic acid CAS Name: 3-(6-bromo-4-oxo-3-quinazolinyl)butanoic acid IUPAC Name: 3-(6-bromo-4-oxoquinazolin-3-yl)butanoic acid Traditional Name: 3-(6-bromo-4-keto-quinazolin-3-yl)butyric acid Formula: C12H11BrN2O3 MolecularWeight: 311.13134

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)N1C=NC2=C(C1=O)C=C(C=C2)Br

Isomeric SMILES

CC(CC(=O)O)N1C=NC2=C(C1=O)C=C(C=C2)Br

InChI

InChI=1S/C12H11BrN2O3/c1-7(4-11(16)17)15-6-14-10-3-2-8(13)5-9(10)12(15)18/h2-3,5-7H,4H2,1H3,(H,16,17)