2-[1-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-6-chloranyl-4-oxidanylidene-2H-quinazolin-3-yl]ethanoic acid

Systemtic Name: 2-[1-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-6-chloranyl-4-oxidanylidene-2H-quinazolin-3-yl]ethanoic acid Openeye Name: 2-[1-[(4-bromo-2-fluoro-phenyl)methyl]-6-chloro-4-oxo-2H-quinazolin-3-yl]acetic acid CAS Name: 2-[1-[(4-bromo-2-fluorophenyl)methyl]-6-chloro-4-oxo-2H-quinazolin-3-yl]acetic acid IUPAC Name: 2-[1-[(4-bromo-2-fluorophenyl)methyl]-6-chloro-4-oxo-2H-quinazolin-3-yl]acetic acid Traditional Name: 2-[1-(4-bromo-2-fluoro-benzyl)-6-chloro-4-keto-2H-quinazolin-3-yl]acetic acid Formula: C17H13BrClFN2O3 MolecularWeight: 427.652123

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Descriptors Computed from Structure

Canonical SMILES:

C1N(C2=C(C=C(C=C2)Cl)C(=O)N1CC(=O)O)CC3=C(C=C(C=C3)Br)F

Isomeric SMILES

C1N(C2=C(C=C(C=C2)Cl)C(=O)N1CC(=O)O)CC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C17H13BrClFN2O3/c18-11-2-1-10(14(20)5-11)7-21-9-22(8-16(23)24)17(25)13-6-12(19)3-4-15(13)21/h1-6H,7-9H2,(H,23,24)