ethyl (2S)-2-[4-oxidanylidene-3-(1-phenylpyrazol-4-yl)-2-(trifluoromethyl)chromen-7-yl]oxypropanoate

Systemtic Name: ethyl (2S)-2-[4-oxidanylidene-3-(1-phenylpyrazol-4-yl)-2-(trifluoromethyl)chromen-7-yl]oxypropanoate Openeye Name: ethyl (2S)-2-[4-oxo-3-(1-phenylpyrazol-4-yl)-2-(trifluoromethyl)chromen-7-yl]oxypropanoate CAS Name: (2S)-2-[[4-oxo-3-(1-phenyl-4-pyrazolyl)-2-(trifluoromethyl)-1-benzopyran-7-yl]oxy]propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[4-oxo-3-(1-phenylpyrazol-4-yl)-2-(trifluoromethyl)chromen-7-yl]oxypropanoate Traditional Name: (2S)-2-[4-keto-3-(1-phenylpyrazol-4-yl)-2-(trifluoromethyl)chromen-7-yl]oxypropionic acid ethyl ester Formula: C24H19F3N2O5 MolecularWeight: 472.41327

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)OC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)C3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)[C@H](C)OC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)C3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H19F3N2O5/c1-3-32-23(31)14(2)33-17-9-10-18-19(11-17)34-22(24(25,26)27)20(21(18)30)15-12-28-29(13-15)16-7-5-4-6-8-16/h4-14H,3H2,1-2H3/t14-/m0/s1