methyl 4-[[8-methyl-2-oxidanylidene-4-(trifluoromethyl)chromen-7-yl]oxymethyl]benzoate

Systemtic Name: methyl 4-[[8-methyl-2-oxidanylidene-4-(trifluoromethyl)chromen-7-yl]oxymethyl]benzoate Openeye Name: methyl 4-[[8-methyl-2-oxo-4-(trifluoromethyl)chromen-7-yl]oxymethyl]benzoate CAS Name: 4-[[8-methyl-2-oxo-4-(trifluoromethyl)-1-benzopyran-7-yl]oxymethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[8-methyl-2-oxo-4-(trifluoromethyl)chromen-7-yl]oxymethyl]benzoate Traditional Name: 4-[[2-keto-8-methyl-4-(trifluoromethyl)chromen-7-yl]oxymethyl]benzoic acid methyl ester Formula: C20H15F3O5 MolecularWeight: 392.32531

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2C(F)(F)F)OCC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2C(F)(F)F)OCC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C20H15F3O5/c1-11-16(27-10-12-3-5-13(6-4-12)19(25)26-2)8-7-14-15(20(21,22)23)9-17(24)28-18(11)14/h3-9H,10H2,1-2H3