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

Systemtic Name: [5,5-bis(diethoxyphosphoryl)-1,4-dihydropyrazol-3-yl]-(4-tert-butylphenyl)methanone Openeye Name: [5,5-bis(diethoxyphosphoryl)-1,4-dihydropyrazol-3-yl]-(4-tert-butylphenyl)methanone CAS Name: [5,5-bis(diethoxyphosphoryl)-1,4-dihydropyrazol-3-yl]-(4-tert-butylphenyl)methanone IUPAC Name: [5,5-bis(diethoxyphosphoryl)-1,4-dihydropyrazol-3-yl]-(4-tert-butylphenyl)methanone Traditional Name: [5,5-bis(diethoxyphosphoryl)-2-pyrazolin-3-yl]-(4-tert-butylphenyl)methanone Formula: C22H36N2O7P2 MolecularWeight: 502.477962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H36N2O7P2/c1-8-28-32(26,29-9-2)22(33(27,30-10-3)31-11-4)16-19(23-24-22)20(25)17-12-14-18(15-13-17)21(5,6)7/h12-15,24H,8-11,16H2,1-7H3