methyl 2-diethoxyphosphoryl-7-(trifluoromethyl)-3,4-dihydrochromeno[4,3-c]pyrazole-3a-carboxylate

Systemtic Name: methyl 2-diethoxyphosphoryl-7-(trifluoromethyl)-3,4-dihydrochromeno[4,3-c]pyrazole-3a-carboxylate Openeye Name: methyl 2-diethoxyphosphoryl-7-(trifluoromethyl)-3,4-dihydrochromeno[4,3-c]pyrazole-3a-carboxylate CAS Name: 2-diethoxyphosphoryl-7-(trifluoromethyl)-3,4-dihydro[1]benzopyrano[4,3-c]pyrazole-3a-carboxylic acid methyl ester IUPAC Name: methyl 2-diethoxyphosphoryl-7-(trifluoromethyl)-3,4-dihydrochromeno[4,3-c]pyrazole-3a-carboxylate Traditional Name: 2-diethoxyphosphoryl-7-(trifluoromethyl)-3,4-dihydrochromeno[4,3-c]pyrazole-3a-carboxylic acid methyl ester Formula: C17H20F3N2O6P MolecularWeight: 436.319471

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(N1CC2(COC3=C(C2=N1)C=CC(=C3)C(F)(F)F)C(=O)OC)OCC

Isomeric SMILES

CCOP(=O)(N1CC2(COC3=C(C2=N1)C=CC(=C3)C(F)(F)F)C(=O)OC)OCC

InChI

InChI=1S/C17H20F3N2O6P/c1-4-27-29(24,28-5-2)22-9-16(15(23)25-3)10-26-13-8-11(17(18,19)20)6-7-12(13)14(16)21-22/h6-8H,4-5,9-10H2,1-3H3