methyl 6-chloranyl-8-(5-fluoranyl-2-oxidanyl-phenyl)carbonyl-11-oxidanylidene-pyrido[2,1-b]quinazoline-3-carboxylate

Systemtic Name: methyl 6-chloranyl-8-(5-fluoranyl-2-oxidanyl-phenyl)carbonyl-11-oxidanylidene-pyrido[2,1-b]quinazoline-3-carboxylate Openeye Name: methyl 6-chloro-8-(5-fluoro-2-hydroxy-benzoyl)-11-oxo-pyrido[2,1-b]quinazoline-3-carboxylate CAS Name: 6-chloro-8-[(5-fluoro-2-hydroxyphenyl)-oxomethyl]-11-oxo-3-pyrido[2,1-b]quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 6-chloro-8-(5-fluoro-2-hydroxybenzoyl)-11-oxopyrido[2,1-b]quinazoline-3-carboxylate Traditional Name: 6-chloro-8-(5-fluoro-2-hydroxy-benzoyl)-11-keto-pyrido[2,1-b]quinazoline-3-carboxylic acid methyl ester Formula: C21H12ClFN2O5 MolecularWeight: 426.781783

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N3C=C(C=C(C3=N2)Cl)C(=O)C4=C(C=CC(=C4)F)O

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N3C=C(C=C(C3=N2)Cl)C(=O)C4=C(C=CC(=C4)F)O

InChI

InChI=1S/C21H12ClFN2O5/c1-30-21(29)10-2-4-13-16(7-10)24-19-15(22)6-11(9-25(19)20(13)28)18(27)14-8-12(23)3-5-17(14)26/h2-9,26H,1H3