methyl 2-[4-oxidanylidene-3-(1-phenylpyrazol-4-yl)oxy-2-(trifluoromethyl)chromen-7-yl]ethanoate

Systemtic Name: methyl 2-[4-oxidanylidene-3-(1-phenylpyrazol-4-yl)oxy-2-(trifluoromethyl)chromen-7-yl]ethanoate Openeye Name: methyl 2-[4-oxo-3-(1-phenylpyrazol-4-yl)oxy-2-(trifluoromethyl)chromen-7-yl]acetate CAS Name: 2-[4-oxo-3-[(1-phenyl-4-pyrazolyl)oxy]-2-(trifluoromethyl)-1-benzopyran-7-yl]acetic acid methyl ester IUPAC Name: methyl 2-[4-oxo-3-(1-phenylpyrazol-4-yl)oxy-2-(trifluoromethyl)chromen-7-yl]acetate Traditional Name: 2-[4-keto-3-(1-phenylpyrazol-4-yl)oxy-2-(trifluoromethyl)chromen-7-yl]acetic acid methyl ester Formula: C22H15F3N2O5 MolecularWeight: 444.36011

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)OC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)CC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)OC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H15F3N2O5/c1-30-18(28)10-13-7-8-16-17(9-13)32-21(22(23,24)25)20(19(16)29)31-15-11-26-27(12-15)14-5-3-2-4-6-14/h2-9,11-12H,10H2,1H3