[3-(2-ethylphenoxy)-4-oxidanylidene-chromen-7-yl] 4-(2-bromanyl-4-chloranyl-phenoxy)butanoate

Systemtic Name: [3-(2-ethylphenoxy)-4-oxidanylidene-chromen-7-yl] 4-(2-bromanyl-4-chloranyl-phenoxy)butanoate Openeye Name: [3-(2-ethylphenoxy)-4-oxo-chromen-7-yl] 4-(2-bromo-4-chloro-phenoxy)butanoate CAS Name: 4-(2-bromo-4-chlorophenoxy)butanoic acid [3-(2-ethylphenoxy)-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(2-ethylphenoxy)-4-oxochromen-7-yl] 4-(2-bromo-4-chlorophenoxy)butanoate Traditional Name: 4-(2-bromo-4-chloro-phenoxy)butyric acid [3-(2-ethylphenoxy)-4-keto-chromen-7-yl] ester Formula: C27H22BrClO6 MolecularWeight: 557.81698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1OC2=COC3=C(C2=O)C=CC(=C3)OC(=O)CCCOC4=C(C=C(C=C4)Cl)Br

Isomeric SMILES

CCC1=CC=CC=C1OC2=COC3=C(C2=O)C=CC(=C3)OC(=O)CCCOC4=C(C=C(C=C4)Cl)Br

InChI

InChI=1S/C27H22BrClO6/c1-2-17-6-3-4-7-22(17)35-25-16-33-24-15-19(10-11-20(24)27(25)31)34-26(30)8-5-13-32-23-12-9-18(29)14-21(23)28/h3-4,6-7,9-12,14-16H,2,5,8,13H2,1H3