ethyl 5-di(propan-2-yloxy)phosphoryl-4-(trifluoromethyl)-1H-pyrazole-3-carboxylate

Systemtic Name: ethyl 5-di(propan-2-yloxy)phosphoryl-4-(trifluoromethyl)-1H-pyrazole-3-carboxylate Openeye Name: ethyl 5-diisopropoxyphosphoryl-4-(trifluoromethyl)-1H-pyrazole-3-carboxylate CAS Name: 5-di(propan-2-yloxy)phosphoryl-4-(trifluoromethyl)-1H-pyrazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-di(propan-2-yloxy)phosphoryl-4-(trifluoromethyl)-1H-pyrazole-3-carboxylate Traditional Name: 5-diisopropoxyphosphoryl-4-(trifluoromethyl)-1H-pyrazole-3-carboxylic acid ethyl ester Formula: C13H20F3N2O5P MolecularWeight: 372.277271

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NNC(=C1C(F)(F)F)P(=O)(OC(C)C)OC(C)C

Isomeric SMILES

CCOC(=O)C1=NNC(=C1C(F)(F)F)P(=O)(OC(C)C)OC(C)C

InChI

InChI=1S/C13H20F3N2O5P/c1-6-21-12(19)10-9(13(14,15)16)11(18-17-10)24(20,22-7(2)3)23-8(4)5/h7-8H,6H2,1-5H3,(H,17,18)