1,8-bis(fluoranyl)-2-octoxy-7-pentoxy-phenanthrene

Systemtic Name: 1,8-bis(fluoranyl)-2-octoxy-7-pentoxy-phenanthrene Openeye Name: 1,8-difluoro-2-octoxy-7-pentoxy-phenanthrene CAS Name: 1,8-difluoro-2-octoxy-7-pentoxyphenanthrene IUPAC Name: 1,8-difluoro-2-octoxy-7-pentoxyphenanthrene Traditional Name: 2-amoxy-1,8-difluoro-7-octoxy-phenanthrene Formula: C27H34F2O2 MolecularWeight: 428.554466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C2=C(C=C1)C3=C(C=C2)C(=C(C=C3)OCCCCC)F)F

Isomeric SMILES

CCCCCCCCOC1=C(C2=C(C=C1)C3=C(C=C2)C(=C(C=C3)OCCCCC)F)F

InChI

InChI=1S/C27H34F2O2/c1-3-5-7-8-9-11-19-31-25-17-15-21-20-14-16-24(30-18-10-6-4-2)26(28)22(20)12-13-23(21)27(25)29/h12-17H,3-11,18-19H2,1-2H3