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

Systemtic Name: 4-[6,8-bis(bromanyl)-2-methyl-4-oxidanylidene-quinazolin-3-yl]benzoic acid Openeye Name: 4-(6,8-dibromo-2-methyl-4-oxo-quinazolin-3-yl)benzoic acid CAS Name: 4-(6,8-dibromo-2-methyl-4-oxo-3-quinazolinyl)benzoic acid IUPAC Name: 4-(6,8-dibromo-2-methyl-4-oxoquinazolin-3-yl)benzoic acid Traditional Name: 4-(6,8-dibromo-4-keto-2-methyl-quinazolin-3-yl)benzoic acid Formula: C16H10Br2N2O3 MolecularWeight: 438.0702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2C(=O)N1C3=CC=C(C=C3)C(=O)O)Br)Br

Isomeric SMILES

CC1=NC2=C(C=C(C=C2C(=O)N1C3=CC=C(C=C3)C(=O)O)Br)Br

InChI

InChI=1S/C16H10Br2N2O3/c1-8-19-14-12(6-10(17)7-13(14)18)15(21)20(8)11-4-2-9(3-5-11)16(22)23/h2-7H,1H3,(H,22,23)