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

Systemtic Name: 2-[(Z)-1-chloranyl-2-(3-fluoranyl-4-methoxy-phenyl)ethenyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: 2-[(Z)-1-chloro-2-(3-fluoro-4-methoxy-phenyl)vinyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[(Z)-1-chloro-2-(3-fluoro-4-methoxyphenyl)ethenyl]-4-oxo-1H-quinazoline-7-carboxylate IUPAC Name: 2-[(Z)-1-chloro-2-(3-fluoro-4-methoxyphenyl)ethenyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[(Z)-1-chloro-2-(3-fluoro-4-methoxy-phenyl)vinyl]-4-keto-1H-quinazoline-7-carboxylate Formula: C18H11ClFN2O4- MolecularWeight: 373.742343

Click to see the large picture

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)/p-1/b12-6-