5-[[2,6-bis(fluoranyl)phenyl]methoxy]-4-butyl-7-methyl-chromen-2-one

Systemtic Name: 5-[[2,6-bis(fluoranyl)phenyl]methoxy]-4-butyl-7-methyl-chromen-2-one Openeye Name: 4-butyl-5-[(2,6-difluorophenyl)methoxy]-7-methyl-chromen-2-one CAS Name: 4-butyl-5-[(2,6-difluorophenyl)methoxy]-7-methyl-1-benzopyran-2-one IUPAC Name: 4-butyl-5-[(2,6-difluorophenyl)methoxy]-7-methylchromen-2-one Traditional Name: 4-butyl-5-(2,6-difluorobenzyl)oxy-7-methyl-coumarin Formula: C21H20F2O3 MolecularWeight: 358.378506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OCC3=C(C=CC=C3F)F

Isomeric SMILES

CCCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OCC3=C(C=CC=C3F)F

InChI

InChI=1S/C21H20F2O3/c1-3-4-6-14-11-20(24)26-19-10-13(2)9-18(21(14)19)25-12-15-16(22)7-5-8-17(15)23/h5,7-11H,3-4,6,12H2,1-2H3