(5-methyl-2-propan-2-yl-cyclohexyl) 2-[4-oxidanylidene-3-(1-phenylpyrazol-4-yl)oxy-2-(trifluoromethyl)chromen-7-yl]oxyethanoate

Systemtic Name: (5-methyl-2-propan-2-yl-cyclohexyl) 2-[4-oxidanylidene-3-(1-phenylpyrazol-4-yl)oxy-2-(trifluoromethyl)chromen-7-yl]oxyethanoate Openeye Name: (2-isopropyl-5-methyl-cyclohexyl) 2-[4-oxo-3-(1-phenylpyrazol-4-yl)oxy-2-(trifluoromethyl)chromen-7-yl]oxyacetate CAS Name: 2-[[4-oxo-3-[(1-phenyl-4-pyrazolyl)oxy]-2-(trifluoromethyl)-1-benzopyran-7-yl]oxy]acetic acid (5-methyl-2-propan-2-ylcyclohexyl) ester IUPAC Name: (5-methyl-2-propan-2-ylcyclohexyl) 2-[4-oxo-3-(1-phenylpyrazol-4-yl)oxy-2-(trifluoromethyl)chromen-7-yl]oxyacetate Traditional Name: 2-[4-keto-3-(1-phenylpyrazol-4-yl)oxy-2-(trifluoromethyl)chromen-7-yl]oxyacetic acid (2-isopropyl-5-methyl-cyclohexyl) ester Formula: C31H31F3N2O6 MolecularWeight: 584.58285

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)COC2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)OC4=CN(N=C4)C5=CC=CC=C5)C(C)C

Isomeric SMILES

CC1CCC(C(C1)OC(=O)COC2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)OC4=CN(N=C4)C5=CC=CC=C5)C(C)C

InChI

InChI=1S/C31H31F3N2O6/c1-18(2)23-11-9-19(3)13-25(23)41-27(37)17-39-21-10-12-24-26(14-21)42-30(31(32,33)34)29(28(24)38)40-22-15-35-36(16-22)20-7-5-4-6-8-20/h4-8,10,12,14-16,18-19,23,25H,9,11,13,17H2,1-3H3