4-butyl-7-[(2-chloranyl-4-fluoranyl-phenyl)methoxy]-8-methyl-chromen-2-one

Systemtic Name: 4-butyl-7-[(2-chloranyl-4-fluoranyl-phenyl)methoxy]-8-methyl-chromen-2-one Openeye Name: 4-butyl-7-[(2-chloro-4-fluoro-phenyl)methoxy]-8-methyl-chromen-2-one CAS Name: 4-butyl-7-[(2-chloro-4-fluorophenyl)methoxy]-8-methyl-1-benzopyran-2-one IUPAC Name: 4-butyl-7-[(2-chloro-4-fluorophenyl)methoxy]-8-methylchromen-2-one Traditional Name: 4-butyl-7-(2-chloro-4-fluoro-benzyl)oxy-8-methyl-coumarin Formula: C21H20ClFO3 MolecularWeight: 374.833103

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C1C=CC(=C2C)OCC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

CCCCC1=CC(=O)OC2=C1C=CC(=C2C)OCC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C21H20ClFO3/c1-3-4-5-14-10-20(24)26-21-13(2)19(9-8-17(14)21)25-12-15-6-7-16(23)11-18(15)22/h6-11H,3-5,12H2,1-2H3