7-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-3-hexyl-4,8-dimethyl-chromen-2-one

Systemtic Name: 7-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-3-hexyl-4,8-dimethyl-chromen-2-one Openeye Name: 7-[(2-chloro-6-fluoro-phenyl)methoxy]-3-hexyl-4,8-dimethyl-chromen-2-one CAS Name: 7-[(2-chloro-6-fluorophenyl)methoxy]-3-hexyl-4,8-dimethyl-1-benzopyran-2-one IUPAC Name: 7-[(2-chloro-6-fluorophenyl)methoxy]-3-hexyl-4,8-dimethylchromen-2-one Traditional Name: 7-(2-chloro-6-fluoro-benzyl)oxy-3-hexyl-4,8-dimethyl-coumarin Formula: C24H26ClFO3 MolecularWeight: 416.912843

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C2=C(C(=C(C=C2)OCC3=C(C=CC=C3Cl)F)C)OC1=O)C

Isomeric SMILES

CCCCCCC1=C(C2=C(C(=C(C=C2)OCC3=C(C=CC=C3Cl)F)C)OC1=O)C

InChI

InChI=1S/C24H26ClFO3/c1-4-5-6-7-9-18-15(2)17-12-13-22(16(3)23(17)29-24(18)27)28-14-19-20(25)10-8-11-21(19)26/h8,10-13H,4-7,9,14H2,1-3H3