[3-(4-tert-butylphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 3,6-bis(chloranyl)-2-methoxy-benzoate

Systemtic Name: [3-(4-tert-butylphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 3,6-bis(chloranyl)-2-methoxy-benzoate Openeye Name: [3-(4-tert-butylphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 3,6-dichloro-2-methoxy-benzoate CAS Name: 3,6-dichloro-2-methoxybenzoic 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] 3,6-dichloro-2-methoxybenzoate Traditional Name: 3,6-dichloro-2-methoxy-benzoic acid [3-(4-tert-butylphenoxy)-4-keto-2-(trifluoromethyl)chromen-7-yl] ester Formula: C28H21Cl2F3O6 MolecularWeight: 581.36395

Click to see the large picture

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=CC(=C4OC)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=CC(=C4OC)Cl)Cl)C(F)(F)F

InChI

InChI=1S/C28H21Cl2F3O6/c1-27(2,3)14-5-7-15(8-6-14)37-24-22(34)17-10-9-16(13-20(17)39-25(24)28(31,32)33)38-26(35)21-18(29)11-12-19(30)23(21)36-4/h5-13H,1-4H3