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

Systemtic Name: [3-(4-tert-butylphenoxy)-4-oxidanylidene-chromen-7-yl] 4-(2-bromanyl-4-chloranyl-phenoxy)butanoate Openeye Name: [3-(4-tert-butylphenoxy)-4-oxo-chromen-7-yl] 4-(2-bromo-4-chloro-phenoxy)butanoate CAS Name: 4-(2-bromo-4-chlorophenoxy)butanoic acid [3-(4-tert-butylphenoxy)-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(4-tert-butylphenoxy)-4-oxochromen-7-yl] 4-(2-bromo-4-chlorophenoxy)butanoate Traditional Name: 4-(2-bromo-4-chloro-phenoxy)butyric acid [3-(4-tert-butylphenoxy)-4-keto-chromen-7-yl] ester Formula: C29H26BrClO6 MolecularWeight: 585.87014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OC2=COC3=C(C2=O)C=CC(=C3)OC(=O)CCCOC4=C(C=C(C=C4)Cl)Br

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OC2=COC3=C(C2=O)C=CC(=C3)OC(=O)CCCOC4=C(C=C(C=C4)Cl)Br

InChI

InChI=1S/C29H26BrClO6/c1-29(2,3)18-6-9-20(10-7-18)36-26-17-35-25-16-21(11-12-22(25)28(26)33)37-27(32)5-4-14-34-24-13-8-19(31)15-23(24)30/h6-13,15-17H,4-5,14H2,1-3H3