3-ethoxycarbonyl-2,6-dimethyl-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-5-carboxylic acid

Systemtic Name: 3-ethoxycarbonyl-2,6-dimethyl-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-5-carboxylic acid Openeye Name: 3-ethoxycarbonyl-2,6-dimethyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-5-carboxylic acid CAS Name: 3-ethoxycarbonyl-2,6-dimethyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-5-carboxylic acid IUPAC Name: 3-ethoxycarbonyl-2,6-dimethyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-5-carboxylic acid Traditional Name: 3-carbethoxy-7-keto-2,6-dimethyl-1H-pyrazolo[1,5-a]pyrimidine-5-carboxylic acid Formula: C12H13N3O5 MolecularWeight: 279.24872

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NN2C1=NC(=C(C2=O)C)C(=O)O)C

Isomeric SMILES

CCOC(=O)C1=C(NN2C1=NC(=C(C2=O)C)C(=O)O)C

InChI

InChI=1S/C12H13N3O5/c1-4-20-12(19)7-6(3)14-15-9(7)13-8(11(17)18)5(2)10(15)16/h14H,4H2,1-3H3,(H,17,18)