1-fluoranyl-2-octoxy-7-pentoxy-9,10-dihydrophenanthrene

Systemtic Name: 1-fluoranyl-2-octoxy-7-pentoxy-9,10-dihydrophenanthrene Openeye Name: 1-fluoro-2-octoxy-7-pentoxy-9,10-dihydrophenanthrene CAS Name: 1-fluoro-2-octoxy-7-pentoxy-9,10-dihydrophenanthrene IUPAC Name: 1-fluoro-2-octoxy-7-pentoxy-9,10-dihydrophenanthrene Traditional Name: 7-amoxy-1-fluoro-2-octoxy-9,10-dihydrophenanthrene Formula: C27H37FO2 MolecularWeight: 412.579883

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C2=C(C=C1)C3=C(CC2)C=C(C=C3)OCCCCC)F

Isomeric SMILES

CCCCCCCCOC1=C(C2=C(C=C1)C3=C(CC2)C=C(C=C3)OCCCCC)F

InChI

InChI=1S/C27H37FO2/c1-3-5-7-8-9-11-19-30-26-17-16-24-23-15-13-22(29-18-10-6-4-2)20-21(23)12-14-25(24)27(26)28/h13,15-17,20H,3-12,14,18-19H2,1-2H3