ethyl 6-(5-chloranyl-2-oxidanyl-phenyl)carbonylpyrazolo[1,5-a]pyrimidine-3-carboxylate

Systemtic Name: ethyl 6-(5-chloranyl-2-oxidanyl-phenyl)carbonylpyrazolo[1,5-a]pyrimidine-3-carboxylate Openeye Name: ethyl 6-(5-chloro-2-hydroxy-benzoyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate CAS Name: 6-[(5-chloro-2-hydroxyphenyl)-oxomethyl]-3-pyrazolo[1,5-a]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-(5-chloro-2-hydroxybenzoyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate Traditional Name: 6-(5-chloro-2-hydroxy-benzoyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid ethyl ester Formula: C16H12ClN3O4 MolecularWeight: 345.73718

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2N=CC(=CN2N=C1)C(=O)C3=C(C=CC(=C3)Cl)O

Isomeric SMILES

CCOC(=O)C1=C2N=CC(=CN2N=C1)C(=O)C3=C(C=CC(=C3)Cl)O

InChI

InChI=1S/C16H12ClN3O4/c1-2-24-16(23)12-7-19-20-8-9(6-18-15(12)20)14(22)11-5-10(17)3-4-13(11)21/h3-8,21H,2H2,1H3