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

Systemtic Name: methyl 6-chloranyl-8-(5-methoxy-2-oxidanyl-phenyl)carbonyl-11-oxidanylidene-pyrido[2,1-b]quinazoline-3-carboxylate Openeye Name: methyl 6-chloro-8-(2-hydroxy-5-methoxy-benzoyl)-11-oxo-pyrido[2,1-b]quinazoline-3-carboxylate CAS Name: 6-chloro-8-[(2-hydroxy-5-methoxyphenyl)-oxomethyl]-11-oxo-3-pyrido[2,1-b]quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 6-chloro-8-(2-hydroxy-5-methoxybenzoyl)-11-oxopyrido[2,1-b]quinazoline-3-carboxylate Traditional Name: 6-chloro-8-(2-hydroxy-5-methoxy-benzoyl)-11-keto-pyrido[2,1-b]quinazoline-3-carboxylic acid methyl ester Formula: C22H15ClN2O6 MolecularWeight: 438.8173

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)O)C(=O)C2=CN3C(=NC4=C(C3=O)C=CC(=C4)C(=O)OC)C(=C2)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)O)C(=O)C2=CN3C(=NC4=C(C3=O)C=CC(=C4)C(=O)OC)C(=C2)Cl

InChI

InChI=1S/C22H15ClN2O6/c1-30-13-4-6-18(26)15(9-13)19(27)12-7-16(23)20-24-17-8-11(22(29)31-2)3-5-14(17)21(28)25(20)10-12/h3-10,26H,1-2H3