6-bromanyl-3-[4-(4-fluorophenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromen-2-yl]chromen-2-one

Systemtic Name: 6-bromanyl-3-[4-(4-fluorophenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromen-2-yl]chromen-2-one Openeye Name: 6-bromo-3-[4-(4-fluorophenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromen-2-yl]chromen-2-one CAS Name: 6-bromo-3-[4-(4-fluorophenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-2-yl]-1-benzopyran-2-one IUPAC Name: 6-bromo-3-[4-(4-fluorophenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromen-2-yl]chromen-2-one Traditional Name: 6-bromo-3-[4-(4-fluorophenyl)-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromen-2-yl]coumarin Formula: C26H20BrFO4 MolecularWeight: 495.337003

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C=C(O2)C3=CC4=C(C=CC(=C4)Br)OC3=O)C5=CC=C(C=C5)F)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C=C(O2)C3=CC4=C(C=CC(=C4)Br)OC3=O)C5=CC=C(C=C5)F)C(=O)C1)C

InChI

InChI=1S/C26H20BrFO4/c1-26(2)12-20(29)24-18(14-3-6-17(28)7-4-14)11-22(31-23(24)13-26)19-10-15-9-16(27)5-8-21(15)32-25(19)30/h3-11,18H,12-13H2,1-2H3