2-(4-tert-butylphenyl)-6-chloranyl-3-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-7-methyl-chromen-4-one

Systemtic Name: 2-(4-tert-butylphenyl)-6-chloranyl-3-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-7-methyl-chromen-4-one Openeye Name: 2-(4-tert-butylphenyl)-6-chloro-3-[(2-chloro-6-fluoro-phenyl)methoxy]-7-methyl-chromen-4-one CAS Name: 2-(4-tert-butylphenyl)-6-chloro-3-[(2-chloro-6-fluorophenyl)methoxy]-7-methyl-1-benzopyran-4-one IUPAC Name: 2-(4-tert-butylphenyl)-6-chloro-3-[(2-chloro-6-fluorophenyl)methoxy]-7-methylchromen-4-one Traditional Name: 2-(4-tert-butylphenyl)-6-chloro-3-(2-chloro-6-fluoro-benzyl)oxy-7-methyl-chromone Formula: C27H23Cl2FO3 MolecularWeight: 485.374123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)OC(=C(C2=O)OCC3=C(C=CC=C3Cl)F)C4=CC=C(C=C4)C(C)(C)C)Cl

Isomeric SMILES

CC1=C(C=C2C(=C1)OC(=C(C2=O)OCC3=C(C=CC=C3Cl)F)C4=CC=C(C=C4)C(C)(C)C)Cl

InChI

InChI=1S/C27H23Cl2FO3/c1-15-12-23-18(13-21(15)29)24(31)26(32-14-19-20(28)6-5-7-22(19)30)25(33-23)16-8-10-17(11-9-16)27(2,3)4/h5-13H,14H2,1-4H3