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

Systemtic Name: [4-oxidanylidene-3-(4-phenylphenoxy)chromen-7-yl] 4-(2-bromanyl-4-chloranyl-phenoxy)butanoate Openeye Name: [4-oxo-3-(4-phenylphenoxy)chromen-7-yl] 4-(2-bromo-4-chloro-phenoxy)butanoate CAS Name: 4-(2-bromo-4-chlorophenoxy)butanoic acid [4-oxo-3-(4-phenylphenoxy)-1-benzopyran-7-yl] ester IUPAC Name: [4-oxo-3-(4-phenylphenoxy)chromen-7-yl] 4-(2-bromo-4-chlorophenoxy)butanoate Traditional Name: 4-(2-bromo-4-chloro-phenoxy)butyric acid [4-keto-3-(4-phenylphenoxy)chromen-7-yl] ester Formula: C31H22BrClO6 MolecularWeight: 605.85978

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)OC3=COC4=C(C3=O)C=CC(=C4)OC(=O)CCCOC5=C(C=C(C=C5)Cl)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)OC3=COC4=C(C3=O)C=CC(=C4)OC(=O)CCCOC5=C(C=C(C=C5)Cl)Br

InChI

InChI=1S/C31H22BrClO6/c32-26-17-22(33)10-15-27(26)36-16-4-7-30(34)39-24-13-14-25-28(18-24)37-19-29(31(25)35)38-23-11-8-21(9-12-23)20-5-2-1-3-6-20/h1-3,5-6,8-15,17-19H,4,7,16H2