ethyl 3-cyano-6-ethanoyl-7-(iodanylmethyl)-4-methyl-pyrazolo[1,5-a]pyrimidine-7-carboxylate

Systemtic Name: ethyl 3-cyano-6-ethanoyl-7-(iodanylmethyl)-4-methyl-pyrazolo[1,5-a]pyrimidine-7-carboxylate Openeye Name: ethyl 6-acetyl-3-cyano-7-(iodomethyl)-4-methyl-pyrazolo[1,5-a]pyrimidine-7-carboxylate CAS Name: 6-acetyl-3-cyano-7-(iodomethyl)-4-methyl-7-pyrazolo[1,5-a]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-acetyl-3-cyano-7-(iodomethyl)-4-methylpyrazolo[1,5-a]pyrimidine-7-carboxylate Traditional Name: 6-acetyl-3-cyano-7-(iodomethyl)-4-methyl-pyrazolo[1,5-a]pyrimidine-7-carboxylic acid ethyl ester Formula: C14H15IN4O3 MolecularWeight: 414.19837

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(=CN(C2=C(C=NN21)C#N)C)C(=O)C)CI

Isomeric SMILES

CCOC(=O)C1(C(=CN(C2=C(C=NN21)C#N)C)C(=O)C)CI

InChI

InChI=1S/C14H15IN4O3/c1-4-22-13(21)14(8-15)11(9(2)20)7-18(3)12-10(5-16)6-17-19(12)14/h6-7H,4,8H2,1-3H3