methyl 4-[[3-(4-tert-butylphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl]oxymethyl]benzoate

Systemtic Name: methyl 4-[[3-(4-tert-butylphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl]oxymethyl]benzoate Openeye Name: methyl 4-[[3-(4-tert-butylphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxymethyl]benzoate CAS Name: 4-[[3-(4-tert-butylphenoxy)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl]oxymethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(4-tert-butylphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxymethyl]benzoate Traditional Name: 4-[[3-(4-tert-butylphenoxy)-4-keto-2-(trifluoromethyl)chromen-7-yl]oxymethyl]benzoic acid methyl ester Formula: C29H25F3O6 MolecularWeight: 526.50041

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OCC4=CC=C(C=C4)C(=O)OC)C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OCC4=CC=C(C=C4)C(=O)OC)C(F)(F)F

InChI

InChI=1S/C29H25F3O6/c1-28(2,3)19-9-11-20(12-10-19)37-25-24(33)22-14-13-21(15-23(22)38-26(25)29(30,31)32)36-16-17-5-7-18(8-6-17)27(34)35-4/h5-15H,16H2,1-4H3