[5,5-bis(diethoxyphosphoryl)-1,4-dihydropyrazol-3-yl]-pyridin-3-yl-methanone

Systemtic Name: [5,5-bis(diethoxyphosphoryl)-1,4-dihydropyrazol-3-yl]-pyridin-3-yl-methanone Openeye Name: [5,5-bis(diethoxyphosphoryl)-1,4-dihydropyrazol-3-yl]-(3-pyridyl)methanone CAS Name: [5,5-bis(diethoxyphosphoryl)-1,4-dihydropyrazol-3-yl]-(3-pyridinyl)methanone IUPAC Name: [5,5-bis(diethoxyphosphoryl)-1,4-dihydropyrazol-3-yl]-pyridin-3-ylmethanone Traditional Name: [5,5-bis(diethoxyphosphoryl)-2-pyrazolin-3-yl]-(3-pyridyl)methanone Formula: C17H27N3O7P2 MolecularWeight: 447.359702

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1(CC(=NN1)C(=O)C2=CN=CC=C2)P(=O)(OCC)OCC)OCC

Isomeric SMILES

CCOP(=O)(C1(CC(=NN1)C(=O)C2=CN=CC=C2)P(=O)(OCC)OCC)OCC

InChI

InChI=1S/C17H27N3O7P2/c1-5-24-28(22,25-6-2)17(29(23,26-7-3)27-8-4)12-15(19-20-17)16(21)14-10-9-11-18-13-14/h9-11,13,20H,5-8,12H2,1-4H3