2-[(Z)-1-chloranyl-2-(3-fluoranyl-4-methoxy-phenyl)ethenyl]-4-oxidanylidene-1H-quinazoline-7-carboxylic acid

Systemtic Name: 2-[(Z)-1-chloranyl-2-(3-fluoranyl-4-methoxy-phenyl)ethenyl]-4-oxidanylidene-1H-quinazoline-7-carboxylic acid Openeye Name: 2-[(Z)-1-chloro-2-(3-fluoro-4-methoxy-phenyl)vinyl]-4-oxo-1H-quinazoline-7-carboxylic acid CAS Name: 2-[(Z)-1-chloro-2-(3-fluoro-4-methoxyphenyl)ethenyl]-4-oxo-1H-quinazoline-7-carboxylic acid IUPAC Name: 2-[(Z)-1-chloro-2-(3-fluoro-4-methoxyphenyl)ethenyl]-4-oxo-1H-quinazoline-7-carboxylic acid Traditional Name: 2-[(Z)-1-chloro-2-(3-fluoro-4-methoxy-phenyl)vinyl]-4-keto-1H-quinazoline-7-carboxylic acid Formula: C18H12ClFN2O4 MolecularWeight: 374.750283

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C(C2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)O)Cl)F

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C(/C2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)O)\Cl)F

InChI

InChI=1S/C18H12ClFN2O4/c1-26-15-5-2-9(7-13(15)20)6-12(19)16-21-14-8-10(18(24)25)3-4-11(14)17(23)22-16/h2-8H,1H3,(H,24,25)(H,21,22,23)/b12-6-