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

Systemtic Name: methyl 5-(chloromethyl)-7-oxidanylidene-6H-pyrazolo[1,5-a]pyrimidine-3-carboxylate Openeye Name: methyl 5-(chloromethyl)-7-oxo-6H-pyrazolo[1,5-a]pyrimidine-3-carboxylate CAS Name: 5-(chloromethyl)-7-oxo-6H-pyrazolo[1,5-a]pyrimidine-3-carboxylic acid methyl ester IUPAC Name: methyl 5-(chloromethyl)-7-oxo-6H-pyrazolo[1,5-a]pyrimidine-3-carboxylate Traditional Name: 5-(chloromethyl)-7-keto-6H-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:

COC(=O)C1=C2N=C(CC(=O)N2N=C1)CCl

Isomeric SMILES

COC(=O)C1=C2N=C(CC(=O)N2N=C1)CCl

InChI

InChI=1S/C9H8ClN3O3/c1-16-9(15)6-4-11-13-7(14)2-5(3-10)12-8(6)13/h4H,2-3H2,1H3