2-(4-tert-butylphenyl)-6-chloranyl-3-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]chromen-4-one

Systemtic Name: 2-(4-tert-butylphenyl)-6-chloranyl-3-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]chromen-4-one Openeye Name: 2-(4-tert-butylphenyl)-6-chloro-3-[(2-chloro-6-fluoro-phenyl)methoxy]chromen-4-one CAS Name: 2-(4-tert-butylphenyl)-6-chloro-3-[(2-chloro-6-fluorophenyl)methoxy]-1-benzopyran-4-one IUPAC Name: 2-(4-tert-butylphenyl)-6-chloro-3-[(2-chloro-6-fluorophenyl)methoxy]chromen-4-one Traditional Name: 2-(4-tert-butylphenyl)-6-chloro-3-(2-chloro-6-fluoro-benzyl)oxy-chromone Formula: C26H21Cl2FO3 MolecularWeight: 471.347543

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=CC(=C3)Cl)OCC4=C(C=CC=C4Cl)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=CC(=C3)Cl)OCC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C26H21Cl2FO3/c1-26(2,3)16-9-7-15(8-10-16)24-25(31-14-19-20(28)5-4-6-21(19)29)23(30)18-13-17(27)11-12-22(18)32-24/h4-13H,14H2,1-3H3