methyl 2-(5-butylpyrazolo[1,5-a]pyrimidin-7-yl)-2-dimethoxyphosphoryl-ethanoate

Systemtic Name: methyl 2-(5-butylpyrazolo[1,5-a]pyrimidin-7-yl)-2-dimethoxyphosphoryl-ethanoate Openeye Name: methyl 2-(5-butylpyrazolo[1,5-a]pyrimidin-7-yl)-2-dimethoxyphosphoryl-acetate CAS Name: 2-(5-butyl-7-pyrazolo[1,5-a]pyrimidinyl)-2-dimethoxyphosphorylacetic acid methyl ester IUPAC Name: methyl 2-(5-butylpyrazolo[1,5-a]pyrimidin-7-yl)-2-dimethoxyphosphorylacetate Traditional Name: 2-(5-butylpyrazolo[1,5-a]pyrimidin-7-yl)-2-dimethoxyphosphoryl-acetic acid methyl ester Formula: C15H22N3O5P MolecularWeight: 355.326041

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC=NN2C(=C1)C(C(=O)OC)P(=O)(OC)OC

Isomeric SMILES

CCCCC1=NC2=CC=NN2C(=C1)C(C(=O)OC)P(=O)(OC)OC

InChI

InChI=1S/C15H22N3O5P/c1-5-6-7-11-10-12(18-13(17-11)8-9-16-18)14(15(19)21-2)24(20,22-3)23-4/h8-10,14H,5-7H2,1-4H3