[3-(4-tert-butylphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 2,4-bis(chloranyl)benzoate

Systemtic Name: [3-(4-tert-butylphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 2,4-bis(chloranyl)benzoate Openeye Name: [3-(4-tert-butylphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 2,4-dichlorobenzoate CAS Name: 2,4-dichlorobenzoic acid [3-(4-tert-butylphenoxy)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [3-(4-tert-butylphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 2,4-dichlorobenzoate Traditional Name: 2,4-dichlorobenzoic acid [3-(4-tert-butylphenoxy)-4-keto-2-(trifluoromethyl)chromen-7-yl] ester Formula: C27H19Cl2F3O5 MolecularWeight: 551.33797

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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)OC(=O)C4=C(C=C(C=C4)Cl)Cl)C(F)(F)F

Isomeric SMILES

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

InChI

InChI=1S/C27H19Cl2F3O5/c1-26(2,3)14-4-7-16(8-5-14)35-23-22(33)19-11-9-17(13-21(19)37-24(23)27(30,31)32)36-25(34)18-10-6-15(28)12-20(18)29/h4-13H,1-3H3