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

Systemtic Name: 2-(4-tert-butylphenyl)-3-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-6,7-dimethyl-chromen-4-one Openeye Name: 2-(4-tert-butylphenyl)-3-[(2-chloro-6-fluoro-phenyl)methoxy]-6,7-dimethyl-chromen-4-one CAS Name: 2-(4-tert-butylphenyl)-3-[(2-chloro-6-fluorophenyl)methoxy]-6,7-dimethyl-1-benzopyran-4-one IUPAC Name: 2-(4-tert-butylphenyl)-3-[(2-chloro-6-fluorophenyl)methoxy]-6,7-dimethylchromen-4-one Traditional Name: 2-(4-tert-butylphenyl)-3-(2-chloro-6-fluoro-benzyl)oxy-6,7-dimethyl-chromone Formula: C28H26ClFO3 MolecularWeight: 464.955643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)C(C)(C)C)OCC4=C(C=CC=C4Cl)F)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)C(C)(C)C)OCC4=C(C=CC=C4Cl)F)C

InChI

InChI=1S/C28H26ClFO3/c1-16-13-20-24(14-17(16)2)33-26(18-9-11-19(12-10-18)28(3,4)5)27(25(20)31)32-15-21-22(29)7-6-8-23(21)30/h6-14H,15H2,1-5H3