methyl 6-chloranyl-5-methyl-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate

Systemtic Name: methyl 6-chloranyl-5-methyl-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate Openeye Name: methyl 6-chloro-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate CAS Name: 6-chloro-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylic acid methyl ester IUPAC Name: methyl 6-chloro-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate Traditional Name: 6-chloro-7-keto-5-methyl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylic acid methyl ester Formula: C9H8ClN3O3 MolecularWeight: 241.63112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N2C(=N1)C(=CN2)C(=O)OC)Cl

Isomeric SMILES

CC1=C(C(=O)N2C(=N1)C(=CN2)C(=O)OC)Cl

InChI

InChI=1S/C9H8ClN3O3/c1-4-6(10)8(14)13-7(12-4)5(3-11-13)9(15)16-2/h3,11H,1-2H3