2,3-bis(fluoranyl)-1-heptoxy-4-(2-phenylethynyl)benzene

Systemtic Name: 2,3-bis(fluoranyl)-1-heptoxy-4-(2-phenylethynyl)benzene Openeye Name: 2,3-difluoro-1-heptoxy-4-(2-phenylethynyl)benzene CAS Name: 2,3-difluoro-1-heptoxy-4-(2-phenylethynyl)benzene IUPAC Name: 2,3-difluoro-1-heptoxy-4-(2-phenylethynyl)benzene Traditional Name: 2,3-difluoro-1-heptoxy-4-(2-phenylethynyl)benzene Formula: C21H22F2O MolecularWeight: 328.395586

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=C(C(=C(C=C1)C#CC2=CC=CC=C2)F)F

Isomeric SMILES

CCCCCCCOC1=C(C(=C(C=C1)C#CC2=CC=CC=C2)F)F

InChI

InChI=1S/C21H22F2O/c1-2-3-4-5-9-16-24-19-15-14-18(20(22)21(19)23)13-12-17-10-7-6-8-11-17/h6-8,10-11,14-15H,2-5,9,16H2,1H3