4-[6,8-bis(bromanyl)-4-oxidanylidene-2-phenyl-quinazolin-3-yl]benzoic acid

Systemtic Name: 4-[6,8-bis(bromanyl)-4-oxidanylidene-2-phenyl-quinazolin-3-yl]benzoic acid Openeye Name: 4-(6,8-dibromo-4-oxo-2-phenyl-quinazolin-3-yl)benzoic acid CAS Name: 4-(6,8-dibromo-4-oxo-2-phenyl-3-quinazolinyl)benzoic acid IUPAC Name: 4-(6,8-dibromo-4-oxo-2-phenylquinazolin-3-yl)benzoic acid Traditional Name: 4-(6,8-dibromo-4-keto-2-phenyl-quinazolin-3-yl)benzoic acid Formula: C21H12Br2N2O3 MolecularWeight: 500.13958

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3C(=O)N2C4=CC=C(C=C4)C(=O)O)Br)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3C(=O)N2C4=CC=C(C=C4)C(=O)O)Br)Br

InChI

InChI=1S/C21H12Br2N2O3/c22-14-10-16-18(17(23)11-14)24-19(12-4-2-1-3-5-12)25(20(16)26)15-8-6-13(7-9-15)21(27)28/h1-11H,(H,27,28)