2-[(Z)-2-(3-bromanyl-4-fluoranyl-phenyl)-1-chloranyl-ethenyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: 2-[(Z)-2-(3-bromanyl-4-fluoranyl-phenyl)-1-chloranyl-ethenyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: 2-[(Z)-2-(3-bromo-4-fluoro-phenyl)-1-chloro-vinyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[(Z)-2-(3-bromo-4-fluorophenyl)-1-chloroethenyl]-4-oxo-1H-quinazoline-7-carboxylate IUPAC Name: 2-[(Z)-2-(3-bromo-4-fluorophenyl)-1-chloroethenyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[(Z)-2-(3-bromo-4-fluoro-phenyl)-1-chloro-vinyl]-4-keto-1H-quinazoline-7-carboxylate Formula: C17H8BrClFN2O3- MolecularWeight: 422.612423

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=C(C2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)[O-])Cl)Br)F

Isomeric SMILES

C1=CC(=C(C=C1/C=C(/C2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)[O-])\Cl)Br)F

InChI

InChI=1S/C17H9BrClFN2O3/c18-11-5-8(1-4-13(11)20)6-12(19)15-21-14-7-9(17(24)25)2-3-10(14)16(23)22-15/h1-7H,(H,24,25)(H,21,22,23)/p-1/b12-6-