methyl 4-[4-oxidanylidene-7-phenylmethoxy-2-(trifluoromethyl)chromen-3-yl]benzoate

Systemtic Name: methyl 4-[4-oxidanylidene-7-phenylmethoxy-2-(trifluoromethyl)chromen-3-yl]benzoate Openeye Name: methyl 4-[7-benzyloxy-4-oxo-2-(trifluoromethyl)chromen-3-yl]benzoate CAS Name: 4-[4-oxo-7-phenylmethoxy-2-(trifluoromethyl)-1-benzopyran-3-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-oxo-7-phenylmethoxy-2-(trifluoromethyl)chromen-3-yl]benzoate Traditional Name: 4-[7-benzoxy-4-keto-2-(trifluoromethyl)chromen-3-yl]benzoic acid methyl ester Formula: C25H17F3O5 MolecularWeight: 454.39469

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=C(OC3=C(C2=O)C=CC(=C3)OCC4=CC=CC=C4)C(F)(F)F

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=C(OC3=C(C2=O)C=CC(=C3)OCC4=CC=CC=C4)C(F)(F)F

InChI

InChI=1S/C25H17F3O5/c1-31-24(30)17-9-7-16(8-10-17)21-22(29)19-12-11-18(32-14-15-5-3-2-4-6-15)13-20(19)33-23(21)25(26,27)28/h2-13H,14H2,1H3